"()-1,1'-Binaphthyl-2,2'-diyl Hydrogenphosphate": 'OP1(=O)Oc2ccc3c(c2-c2c(O1)ccc1c2cccc1)cccc3' "()-10-Camphorsulfonic Acid": 'O=C1CC2C(C1(CC2)CS(=O)(=O)O)(C)C' "(+)-(5aR,10bS)-5a,10b-Dihydro-2-(2,4,6-trimethylphenyl)-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazinium Chloride Monohydrate": 'Cc1cc(C)c(c(c1)C)n1c[n+]2c(n1)CO[C@H]1[C@@H]2c2ccccc2C1.[Cl-].O' "(+)-10,2-Camphorsultam": 'O=S1(=O)NC2C3(C1)CCC(C2)C3(C)C' "(+)-10-Camphorsulfonic Acid": 'O=C1CC2C(C1(CC2)CS(=O)(=O)O)(C)C' "(+)-2,2'-Methylenebis[(3aR,8aS)-3a,8a-dihydro-8H-indeno[1,2-d]oxazole]": 'c1ccc2c(c1)[C@H]1N=C(O[C@H]1C2)CC1=N[C@H]2[C@@H](O1)Cc1c2cccc1' "(+)-4,5-Bis[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolane": 'OC(c1ccccc1)(c1ccccc1)C1OC(OC1C(c1ccccc1)(c1ccccc1)O)(C)C' "(+)-4,5-Bis[hydroxy(diphenyl)methyl]-2-methyl-2-phenyl-1,3-dioxolane": 'OC(C1OC(OC1C(c1ccccc1)(c1ccccc1)O)(C)c1ccccc1)(c1ccccc1)c1ccccc1' "(+)-B-Chlorodiisopinocampheylborane": 'CC1C(BC2CC3CC(C2C)C3(C)C)CC2CC1C2(C)C.CN(CCN(C)C)C' "(+)-DAIB": 'CN([C@@H]1C(O)[C@@]2(C(C1CC2)(C)C)C)C' "(+)-DIPT": 'O[C@H]([C@H](C(=O)OC(C)C)O)C(=O)OC(C)C' "(+)-MIB": 'OC1[C@@H](N2CCOCC2)C2C([C@]1(C)CC2)(C)C' "(+)-NMDPP": 'CC1CCC(C(C1)P(c1ccccc1)c1ccccc1)C(C)C' "(+)-Prophos": 'C[C@@H](P(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1' "(+)-Sparteine": 'C1CC[C@@H]2N(C1)C[C@@H]1C[C@H]2CN2[C@@H]1CCCC2' "(-)-(5aS,10bR)-5a,10b-Dihydro-2-(2,4,6-trimethylphenyl)-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazinium Chloride Monohydrate": 'Cc1cc(C)c(c(c1)C)n1c[n+]2c(n1)CO[C@@H]1[C@H]2c2ccccc2C1.[Cl-].O' "(-)-10,2-Camphorsultam": 'O=S1(=O)NC2C3(C1)CCC(C2)C3(C)C' "(-)-10-Camphorsulfonic Acid": 'O=C1CC2C(C1(CC2)CS(=O)(=O)O)(C)C' "(-)-2,2'-Methylenebis[(3aS,8aR)-3a,8a-dihydro-8H-indeno[1,2-d]oxazole]": 'c1ccc2c(c1)[C@@H]1N=C(O[C@@H]1C2)CC1=N[C@@H]2[C@H](O1)Cc1c2cccc1' "(-)-4,5-Bis[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolane": 'OC(c1ccccc1)(c1ccccc1)C1OC(OC1C(c1ccccc1)(c1ccccc1)O)(C)C' "(-)-B-Chlorodiisopinocampheylborane": 'ClB(C1CC2CC(C1C)C2(C)C)C1CC2CC(C1C)C2(C)C' "(-)-Benzotetramisole": 'c1ccc(cc1)[C@H]1CN2C(=N1)Sc1c2cccc1' "(-)-DIPT": 'O[C@@H]([C@@H](C(=O)OC(C)C)O)C(=O)OC(C)C' "(-)-DMMA": 'CC1CCC(C(C1)N(C)C)C(C)C' "(-)-Isopinocampheylborane TMEDA Complex": 'B[C@@H]1CC2CC([C@H]1C)C2(C)C.B[C@@H]1CC2CC([C@H]1C)C2(C)C.CN(CCN(C)C)C' "(-)-MIB": 'OC1[C@H](N2CCOCC2)C2C([C@@]1(C)CC2)(C)C' "(-)-Sparteine": 'C1CC[C@@H]2N(C1)C[C@@H]1C[C@H]2CN2[C@@H]1CCCC2' "(-)-ephos": 'CN(C(C(c1ccccc1)OP(c1ccccc1)c1ccccc1)C)P(c1ccccc1)c1ccccc1' "(-)-norphos": 'C1=CC2CC1[C@H]([C@@H]2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1' "(1,10-Phenanthroline)(trifluoromethyl)(triphenylphosphine)copper(I)": 'c1ccc2c(n1)c1ncccc1cc2.c1ccc(cc1)P(c1ccccc1)c1ccccc1.FC([Cu])(F)F' "(1,5-Cyclooctadiene)(methoxy)iridium(I)": 'C1CC=CCCC=C1.CO[Ir]' "(1,5-Cyclooctadiene)(pyridine)(tricyclohexylphosphine)iridium(I) Hexafluorophosphate": 'C1CC=CCCC=C1.c1cccnc1.C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.F[P-](F)(F)(F)(F)F.[Ir+]' "(1-Bromovinyl)trimethylsilane": 'BrC(=C)[Si](C)(C)C' "(11R,12R)-9,10-Dihydro-9,10-ethanoanthracene-11,12-diamine": 'N[C@H]1[C@H](N)C2c3c(C1c1c2cccc1)cccc3' "(11S,12S)-9,10-Dihydro-9,10-ethanoanthracene-11,12-diamine": 'N[C@@H]1[C@@H](N)C2c3c(C1c1c2cccc1)cccc3' "(1E)-1-tert-Butoxy-1-(trimethylsilyloxy)propene": 'C/C=C(/O[Si](C)(C)C)\OC(C)(C)C' "(1R,2R)-(+)-1,2-Diphenylethylenediamine": 'N[C@@H]([C@@H](c1ccccc1)N)c1ccccc1' "(1R,2R)-(-)-1,2-Cyclohexanediamine": 'N[C@@H]1CCCC[C@H]1N' "(1R,2R)-(-)-N,N'-Dimethylcyclohexane-1,2-diamine": 'CN[C@@H]1CCCC[C@H]1NC' "(1R,2R)-1,2-Bis(2,4,6-trimethylphenyl)ethylenediamine": 'N[C@H](c1c(C)cc(cc1C)C)[C@@H](c1c(C)cc(cc1C)C)N' "(1R,2R)-1,2-Bis(2-hydroxyphenyl)ethylenediamine": 'N[C@@H]([C@@H](c1ccccc1O)N)c1ccccc1O' "(1R,2R)-N,N'-Bis(2-acetyl-3-oxo-2-butenylidene)-1,2-dimesitylethylenediaminato Cobalt(II)": '[O-]C/C(=C\C=N\[C@H](c1c(C)cc(cc1C)C)[C@@H](c1c(C)cc(cc1C)C)/N=C/C=C(/C(=O)C)\C[O-])/C(=O)C.[Co+2]' "(1R,2R)-N,N'-Bis[3-oxo-2-(2,4,6-trimethylbenzoyl)butylidene]-1,2-diphenylethylenediaminato Cobalt(II)": 'Cc1cc(C)c(c(c1)C)C(=O)/C(=C(\C)/[O-])/C=N/[C@@H]([C@@H](c1ccccc1)/N=C/C(=C(/C)\[O-])/C(=O)c1c(C)cc(cc1C)C)c1ccccc1.[Co+2]' "(1R,2R)-N,N'-Dihydroxy-N,N'-bis(diphenylacetyl)cyclohexane-1,2-diamine": 'ON([C@@H]1CCCC[C@H]1N(C(=O)C(c1ccccc1)c1ccccc1)O)C(=O)C(c1ccccc1)c1ccccc1' "(1R,2R,4R,5R)-2,5-Bis(3,5-di-tert-butyl-2-hydroxybenzylideneamino)bicyclo[2.2.1]heptane": 'Oc1c(/C=N/[C@@H]2C[C@H]3C[C@@H]2C[C@H]3/N=C/c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)cc(cc1C(C)(C)C)C(C)(C)C' "(1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenyl-1-propanol": 'Cc1cc(C)c(c(c1)C)S(=O)(=O)N([C@H]([C@@H](c1ccccc1)O)C)Cc1ccccc1' "(1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Propionate [Reagent foranti-selective asymmetric aldol reaction]": 'CCC(=O)O[C@@H]([C@@H](N(S(=O)(=O)c1c(C)cc(cc1C)C)Cc1ccccc1)C)c1ccccc1' "(1R,3R)-5-(Bromomethylene)-1,3-bis(tert-butyldimethylsilyloxy)cyclohexane": 'BrC=C1C[C@H](C[C@@H](C1)O[Si](C(C)(C)C)(C)C)O[Si](C(C)(C)C)(C)C' "(1R,3S,5R,7R,8aS)-7-Ethylhexahydro-1-(6-hydroxy-4-quinolinyl)-3,7-methano-1H-pyrrolo[2,1-c][1,4]oxazine": 'CC[C@@]12C[C@H]3C[N@@](C1)[C@@H](C2)[C@H](O3)c1ccnc2c1cc(O)cc2' "(1R,4R,5R)-4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane": 'C[C@@H]1CC[C@@H]2C[C@H]1SC2(C)C' "(1S)-3-(1,10-Phenanthrolin-2-yl)-2'-phenyl-[1,1'-binaphthalen]-2-ol": 'Oc1c(cc2c(c1c1c(ccc3c1cccc3)c1ccccc1)cccc2)c1ccc2c(n1)c1ncccc1cc2' "(1S,2R)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenyl-1-propanol": 'Cc1cc(C)c(c(c1)C)S(=O)(=O)N([C@@H]([C@H](c1ccccc1)O)C)Cc1ccccc1' "(1S,2R)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Propionate": 'CCC(=O)O[C@H]([C@H](N(S(=O)(=O)c1c(C)cc(cc1C)C)Cc1ccccc1)C)c1ccccc1' "(1S,2S)-(+)-1,2-Cyclohexanediamine": 'N[C@H]1CCCC[C@@H]1N' "(1S,2S)-(+)-N,N'-Dimethylcyclohexane-1,2-diamine": 'CN[C@H]1CCCC[C@@H]1NC' "(1S,2S)-(-)-1,2-Diphenylethylenediamine": 'N[C@H]([C@H](c1ccccc1)N)c1ccccc1' "(1S,2S)-1,2-Bis(2,4,6-trimethylphenyl)ethylenediamine": 'N[C@@H](c1c(C)cc(cc1C)C)[C@H](c1c(C)cc(cc1C)C)N' "(1S,2S)-1,2-Bis(2-hydroxyphenyl)ethylenediamine": 'N[C@H]([C@H](c1ccccc1O)N)c1ccccc1O' "(1S,2S)-N,N'-Bis(2-acetyl-3-oxo-2-butenylidene)-1,2-dimesitylethylenediaminato Cobalt(II)": '[O-]C/C(=C\C=N\[C@@H](c1c(C)cc(cc1C)C)[C@H](c1c(C)cc(cc1C)C)/N=C/C=C(/C(=O)C)\C[O-])/C(=O)C.[Co+2]' "(1S,2S)-N,N'-Bis[(R)-2-hydroxy-2'-phenyl-1,1'-binaphthyl-3-ylmethylene]-1,2-diphenylethylenediaminato Manganese(III) Acetate": 'Oc1c(c2ccccc2cc1C1=N[C@@H](c2ccccc2)[C@@H](N=C([Mn+]1)c1cc2ccccc2c(c1O)c1c(ccc2c1cccc2)c1ccccc1)c1ccccc1)c1c(ccc2c1cccc2)c1ccccc1.[O-]C(=O)C' "(1S,2S)-N,N'-Bis[3-oxo-2-(2,4,6-trimethylbenzoyl)butylidene]-1,2-diphenylethylenediaminato Cobalt(II)": 'Cc1cc(C)c(c(c1)C)C(=O)/C(=C(\C)/[O-])/C=N/[C@H]([C@H](c1ccccc1)/N=C/C(=C(/C)\[O-])/C(=O)c1c(C)cc(cc1C)C)c1ccccc1.[Co+2]' "(1S,2S)-N,N'-Dihydroxy-N,N'-bis(diphenylacetyl)cyclohexane-1,2-diamine": 'ON([C@H]1CCCC[C@@H]1N(C(=O)C(c1ccccc1)c1ccccc1)O)C(=O)C(c1ccccc1)c1ccccc1' "(1S,2S,4S,5S)-2,5-Bis(3,5-di-tert-butyl-2-hydroxybenzylideneamino)bicyclo[2.2.1]heptane": 'Oc1c(/C=N/[C@H]2C[C@@H]3C[C@H]2C[C@@H]3/N=C/c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)cc(cc1C(C)(C)C)C(C)(C)C' "(1S,4S,5S)-4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane": 'C[C@H]1CC[C@H]2C[C@@H]1SC2(C)C' "(2,5-Dimethylphenyl)magnesium Bromide": 'Br[Mg]c1cc(C)ccc1C' "(2-Bromo-4,5-dimethoxyphenoxy)trimethylsilane": 'COc1cc(O[Si](C)(C)C)c(cc1OC)Br' "(2-Bromoallyl)trimethylsilane": 'BrC(=C)C[Si](C)(C)C' "(2-Bromophenyl)diphenylphosphine": 'Brc1ccccc1P(c1ccccc1)c1ccccc1' "(2-Bromophenylethynyl)trimethylsilane": 'Brc1ccccc1C#C[Si](C)(C)C' "(2R,3R)-(-)-1,4-Bis(diphenylphosphino)-2,3-O-isopropylidene-2,3-butanediol": 'CC1(C)O[C@H]([C@@H](O1)CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1' "(2R,3R)-(-)-2,3-Bis(diphenylphosphino)bicyclo[2.2.1]hept-5-ene": 'C1=CC2CC1[C@H]([C@@H]2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1' "(2R,5R)-2,5-Diphenylpyrrolidine": 'C1C[C@@H](N[C@H]1c1ccccc1)c1ccccc1' "(2R,8aS)-(+)-(Camphorylsulfonyl)oxaziridine": 'O=C1CC2C(C1(CC2)CS(=O)(=O)N1CO1)(C)C' "(2S)-N-[(1S)-1-(Hydroxydiphenylmethyl)-3-methylbutyl]-2-pyrrolidinecarboxamide": 'CC(C[C@@H](C(c1ccccc1)(c1ccccc1)O)NC(=O)[C@@H]1CCCN1)C' "(2S,3R)-3,4-Dihydro-3-isopropyl-2-phenyl-2H-pyrimido[2,1-b]benzothiazole": 'CC([C@@H]1CN2C(=N[C@@H]1c1ccccc1)Sc1c2cccc1)C' "(2S,3S)-(+)-1,4-Bis(diphenylphosphino)-2,3-O-isopropylidene-2,3-butanediol": 'CC1(C)O[C@@H]([C@H](O1)CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1' "(2S,3S)-(+)-2,3-Bis(diphenylphosphino)bicyclo[2.2.1]hept-5-ene": 'C1=CC2CC1[C@@H]([C@H]2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1' "(2S,3S)-(-)-Bis(diphenylphosphino)butane": 'C[C@H](P(c1ccccc1)c1ccccc1)[C@@H](P(c1ccccc1)c1ccccc1)C' "(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic Acid": 'OC(=O)[C@@H]1C[C@H]2[C@@H](N1)CCCC2' "(2S,5S)-(-)-2-tert-Butyl-3-methyl-5-benzyl-4-imidazolidinone": 'CN1C(=O)[C@@H](N[C@@H]1C(C)(C)C)Cc1ccccc1' "(2S,5S)-2,5-Diphenylpyrrolidine": 'C1C[C@H](N[C@@H]1c1ccccc1)c1ccccc1' "(2S,8aR)-(-)-(Camphorylsulfonyl)oxaziridine": 'O=C1CC2C(C1(CC2)CS(=O)(=O)N1CO1)(C)C' "(3,5-Dibromophenyl)triphenylsilane": 'Brc1cc(Br)cc(c1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "(3-Bromopropoxy)(tert-butyl)dimethylsilane": 'BrCCCO[Si](C(C)(C)C)(C)C' "(3-Bromopropyl)trimethoxysilane": 'BrCCC[Si](OC)(OC)OC' "(3-Chloropropyl)tris(trimethylsilyloxy)silane": 'ClCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C' "(3-Mercaptopropyl)triethoxysilane": 'SCCC[Si](OCC)(OCC)OCC' "(3-Mercaptopropyl)trimethoxysilane": 'SCCC[Si](OC)(OC)OC' "(3-Phenyl-1H-inden-1-ylidene)bis(tricyclohexylphosphine)ruthenium(II) Dichloride": 'C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.[Ru+2]=C1C=C(c2c1cccc2)c1ccccc1.[Cl-].[Cl-]' "(4-Dimethylaminophenyl)di-tert-butylphosphine": 'CN(c1ccc(cc1)P(C(C)(C)C)C(C)(C)C)C' "(4R)-(+)-4-Isopropyl-5,5-diphenyl-2-oxazolidinone": 'CC([C@H]1NC(=O)OC1(c1ccccc1)c1ccccc1)C' "(4R,5R)-1,3-Dimethyl-4,5-diphenyl-2-[(S)-1-benzyl-2-hydroxyethylimino]imidazolidine": 'OC[C@@H](N=C1N(C)[C@@H]([C@H](N1C)c1ccccc1)c1ccccc1)Cc1ccccc1' "(4S)-(-)-4-Isopropyl-5,5-diphenyl-2-oxazolidinone": 'CC([C@@H]1NC(=O)OC1(c1ccccc1)c1ccccc1)C' "(4S,4'S)-2,2'-(Pentane-3,3'-diyl)bis(4-benzyl-4,5-dihydrooxazole)": 'CCC(C1=N[C@H](CO1)Cc1ccccc1)(C1=N[C@H](CO1)Cc1ccccc1)CC' "(4S,5S)-1,3-Dimethyl-4,5-diphenyl-2-[(R)-1-benzyl-2-hydroxyethylimino]imidazolidine": 'OC[C@H](N=C1N(C)[C@H]([C@@H](N1C)c1ccccc1)c1ccccc1)Cc1ccccc1' "(6-Chloro-1H-benzotriazol-1-yloxy)tripyrrolidinophosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.Clc1ccc2c(c1)n(nn2)O[P+](N1CCCC1)(N1CCCC1)N1CCCC1' "(7-Azabenzotriazol-1-yloxy)tris(dimethylamino)phosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN([P+](N(C)C)(N(C)C)On1nnc2c1nccc2)C' "(Bromodifluoromethyl)trimethylsilane": 'FC([Si](C)(C)C)(Br)F' "(Bromomethyl)trimethylsilane": 'BrC[Si](C)(C)C' "(CH3)2O": 'CC(=O)C' "(CO)2Br2": 'BrC(=O)C(=O)Br' "(CO)2Cl2": 'ClC(=O)C(=O)Cl' "(Chloromethyl)isopropoxydimethylsilane": 'ClC[Si](OC(C)C)(C)C' "(Chloromethyl)trimethylsilane": 'ClC[Si](C)(C)C' "(Diethylamino)sulfur Trifluoride": 'CCN(S(F)(F)F)CC' "(Difluoromethyl)trimethylsilane": 'FC([Si](C)(C)C)F' "(E)-Trimethyl(3,3,3-trifluoro-1-propenyl)silane": 'C[Si](/C=C/C(F)(F)F)(C)C' "(Ferrocenylmethyl)dodecyldimethylammonium Bromide": 'C[N+](CCCCCCCCCCCC)(C)Cc1cccc1.[Del][Fe][Del].[Br-].c2cccc2' "(Ferrocenylmethyl)trimethylammonium Bromide": 'C[N+](C)(C)Cc1cccc1.[Del][Fe][Del].[Br-].c2cccc2' "(Hexamethylbenzene)ruthenium(II) Dichloride": 'Cc1c(C)c(C)c(c(c1C)C)C.[Cl-].[Cl-].[Ru+2]' "(Indenyl)titanium(IV) Trichloride": '[Ti+3]C1C=Cc2c1cccc2.[Cl-].[Cl-].[Cl-]' "(Iodomethyl)trimethylsilane": 'IC[Si](C)(C)C' "(Me2CHMeCH)2BH": 'OC[C@H]([C@H]([C@@H]1O[C@](O)(CBC[C@]2(O)C[C@H](O)[C@H]([C@@H](O2)[C@@H]([C@@H](CO)O)O)NC(=O)C)C[C@@H]([C@H]1NC(=O)C)O)O)O' "(NH4)2S2O3": '[O-]S(=S)(=O)[O-].[NH4+].[NH4+]' "(NH4)2SO4": '[O-]S(=O)(=O)[O-].[NH4+].[NH4+]' "(Pentafluorophenyl)diphenylphosphine": 'Fc1c(P(c2ccccc2)c2ccccc2)c(F)c(c(c1F)F)F' "(Pentamethylcyclopentadienyl)rhodium(III) Dichloride": 'CC1=C(C)C(C(=C1C)[Rh+2])(C)C.[Cl-].[Cl-]' "(Pentamethylcyclopentadienyl)titanium(IV) Trichloride": 'CC1=C(C)C(C(=C1C)[Ti+3])(C)C.[Cl-].[Cl-].[Cl-]' "(Perfluoro-n-octyl)phenyliodonium Trifluoromethanesulfonate": 'FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C([I+]c1ccccc1)(F)F)F.FC(S(=O)(=O)[O-])(F)F' "(Perfluorohexyl)phenyliodonium Trifluoromethanesulfonate": 'FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)([I+]c1ccccc1)F.FC(S(=O)(=O)[O-])(F)F' "(Perfluoropropyl)phenyliodonium Trifluoromethanesulfonate": 'FC(C(C(F)(F)F)(F)F)([I+]c1ccccc1)F.FC(S(=O)(=O)[O-])(F)F' "(Phenylthio)trimethylsilane": 'C[Si](Sc1ccccc1)(C)C' "(Phenylthiomethyl)trimethylsilane": 'C[Si](CSc1ccccc1)(C)C' "(R)-(+)-,-Diphenyl-2-pyrrolidinemethanol": 'OC(c1ccccc1)(c1ccccc1)[C@H]1CCCN1' "(R)-(+)-,-Diphenyl-2-pyrrolidinemethanol Trimethylsilyl Ether": 'C[Si](OC(c1ccccc1)(c1ccccc1)[C@H]1CCCN1)(C)C' "(R)-(+)-1,1'-Bi-2-naphthol": 'Oc1ccc2c(c1c1c(O)ccc3c1cccc3)cccc2' "(R)-(+)-1,1'-Binaphthyl-2,2'-diamine": 'Nc1ccc2c(c1c1c(N)ccc3c1cccc3)cccc2' "(R)-(+)-2,2'-bis(diphenylphosphino)-1,1'-binaphthyl": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1' "(R)-(+)-2-Amino-2'-hydroxy-1,1'-binaphthyl": 'Oc1ccc2c(c1c1c(N)ccc3c1cccc3)cccc2' "(R)-(+)-2-Diphenylphosphino-2'-methoxy-1,1'-binaphthyl": 'COc1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2' "(R)-(+)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-1,1'-bi-2-naphthol": 'Brc1cc2CCCCc2c(c1O)c1c(O)c(Br)cc2c1CCCC2' "(R)-(+)-5,5',6,6',7,7',8,8'-Octahydro-1,1'-bi-2-naphthol": 'Oc1ccc2c(c1c1c(O)ccc3c1CCCC3)CCCC2' "(R)-(+)-BINAP": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1' "(R)-(+)-Indoline-2-carboxylic Acid": 'OC(=O)[C@H]1Cc2c(N1)cccc2' "(R)-(+)-N,N-Dimethyl-1-ferrocenylethylamine": '[CH]1[CH][CH][CH][CH]1.C[C@H]([C]1[CH][CH][CH][CH]1)N(C)C.[Fe]' "(R)-(+)-tert-Butylsulfinamide": 'CC([S@@](=O)N)(C)C' "(R)-(-)-1,1'-Binaphthyl-2,2'-diyl Bis(trifluoromethanesulfonate)": 'O=S(=O)(C(F)(F)F)Oc1ccc2c(c1c1c(ccc3c1cccc3)OS(=O)(=O)C(F)(F)F)cccc2' "(R)-(-)-1,1'-Binaphthyl-2,2'-diyl Hydrogen Phosphate": 'OP1(=O)Oc2ccc3c(c2-c2c(O1)ccc1c2cccc1)cccc3' "(R)-(-)-1-(2-Pyrrolidinylmethyl)pyrrolidine": 'C1CCN(C1)C[C@H]1CCCN1' "(R)-(-)-2-[Hydroxy(diphenyl)methyl]-1-methylpyrrolidine": 'CN1CCC[C@@H]1C(c1ccccc1)(c1ccccc1)O' "(R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone": 'CCC(=O)N1C(=O)OC[C@H]1Cc1ccccc1' "(R)-(-)-4-Isopropyl-3-propionyl-2-oxazolidinone": 'CCC(=O)N1C(=O)OC[C@H]1C(C)C' "(R)-(-)-4-Phenyl-2-oxazolidinone": 'O=C1OC[C@H](N1)c1ccccc1' "(R)-(-)-6,6'-Dibromo-1,1'-bi-2-naphthol": 'Brc1ccc2c(c1)ccc(c2c1c(O)ccc2c1ccc(c2)Br)O' "(R)-(-)-p-Toluenesulfinamide": 'Cc1ccc(cc1)[S@@](=O)N' "(R)-2,2'-Dimethoxy-1,1'-binaphthyl": 'COc1ccc2c(c1c1c(OC)ccc3c1cccc3)cccc2' "(R)-2-(Methoxymethyl)pyrrolidine": 'COC[C@H]1CCCN1' "(R)-3,3'-Bis[[[(1R,2R)-2-(isoindolin-2-yl)-1,2-diphenylethyl]imino]methyl]-1,1'-bi-2-naphthol": 'Oc1c(/C=N/[C@@H]([C@H](N2Cc3c(C2)cccc3)c2ccccc2)c2ccccc2)cc2c(c1c1c(O)c(/C=N/[C@@H]([C@H](N3Cc4c(C3)cccc4)c3ccccc3)c3ccccc3)cc3c1cccc3)cccc2' "(R)-3,3'-Dibromo-1,1'-bi-2-naphthol": 'Brc1cc2ccccc2c(c1O)c1c(O)c(Br)cc2c1cccc2' "(R)-3,3'-Dibromo-2,2'-dimethoxy-1,1'-binaphthyl": 'COc1c(Br)cc2c(c1c1c(OC)c(Br)cc3c1cccc3)cccc2' "(R)-4-Benzyl-2-oxazolidinone": 'O=C1OC[C@H](N1)Cc1ccccc1' "(R)-4-Isopropyl-2-oxazolidinone": 'CC([C@@H]1COC(=O)N1)C' "(R)-4-Phenylthiazolidine-2-thione": 'S=C1SC[C@H](N1)c1ccccc1' "(R)-5,5-Diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine": 'CB1OC([C@@H]2N1CCC2)(c1ccccc1)c1ccccc1' "(R)-Benzyl-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate": 'FC(c1ccc(cc1)[n+]1nc2n(c1Cc1ccccc1)CCC2)(F)F.F[B-](F)(F)F' "(R)-DMTC": 'OC(=O)[C@H]1NCSC1(C)C' "(R)-Glyphos": 'CC1(C)OC[C@@H](O1)CP(c1ccccc1)c1ccccc1' "(R)-N,N-Dimethyl-1-[(S)-1',2-bis(diphenylphosphino)ferrocenyl]ethylamine": 'C[C@@H](N(C)C)c1c(P(C2=CC=CC=C2)C3=CC=CC=C3)ccc1.[Del][Fe][Del].c4(P(C5=CC=CC=C5)C6=CC=CC=C6)cccc4' "(R)-N,N-Dimethyl-1-[(S)-2-(diphenylphosphino)ferrocenyl]ethylamine": 'CN(C)[C@H](c1cccc1)CP(C2=CC=CC=C2)C3=CC=CC=C3.[Del][Fe][Del].c4cccc4' "(R)-N-(2-Benzoylphenyl)-1-benzylpyrrolidine-2-carboxamide": 'O=C([C@H]1CCCN1Cc1ccccc1)Nc1ccccc1C(=O)c1ccccc1' "(R)-binap": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1' "(R,R'')-2,2''-Bis(diphenylphosphino)-1,1''-biferrocene": '[Del][Fe][Del].[Del][Fe][Del].P(C1=CC=CC=C1)(c2cccc2c3cccc3P(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.c7cccc7.c8cccc8' "(R,R)-(+)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline)": 'CC(C1=N[C@@H](CO1)C(C)(C)C)(C1=N[C@@H](CO1)C(C)(C)C)C' "(R,R)-(-)-2,3-Bis(tert-butylmethylphosphino)quinoxaline": 'CP(C(C)(C)C)c1nc2ccccc2nc1P(C(C)(C)C)C' "(R,R)-(-)-2,3-Dimethoxy-1,4-bis(dimethylamino)butane": 'CO[C@@H]([C@@H](CN(C)C)OC)CN(C)C' "(R,R)-(-)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamine": 'Oc1c(/C=N/[C@@H]2CCCC[C@H]2/N=C/c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)cc(cc1C(C)(C)C)C(C)(C)C' "(R,R)-(-)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) Chloride": 'Oc1c(/C=[N]/2\[Mn+]/[N](=C/c3cc(cc(c3O)C(C)(C)C)C(C)(C)C)/[C@H]3[C@H]2CCCC3)cc(cc1C(C)(C)C)C(C)(C)C.[Cl-]' "(R,R)-1,2-Bis[(2-methoxyphenyl)phenylphosphino]ethane": 'COc1ccccc1P(c1ccccc1)CCP(c1ccccc1OC)c1ccccc1' "(R,R)-2,2'-Isopropylidenebis(4-phenyl-2-oxazoline)": 'CC(C1=N[C@@H](CO1)c1ccccc1)(C1=N[C@@H](CO1)c1ccccc1)C' "(R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine": 'CC([C@@H]1COC(=N1)c1cccc(n1)C1=N[C@@H](CO1)C(C)C)C' "(R,R)-2,6-Bis(4-phenyl-2-oxazolin-2-yl)pyridine": 'C1OC(=N[C@@H]1c1ccccc1)c1cccc(n1)C1=N[C@@H](CO1)c1ccccc1' "(R,R)-2-Iodo-1,3-bis[1-(mesitylcarbamoyl)ethoxy]benzene": 'C[C@H](C(=O)Nc1c(C)cc(cc1C)C)Oc1cccc(c1I)O[C@@H](C(=O)Nc1c(C)cc(cc1C)C)C' "(R,R)-DIOXOP": 'c1ccc(cc1)P(c1ccccc1)C[C@@H]1OC[C@@H](O1)CP(c1ccccc1)c1ccccc1' "(R,R)-N-(2-Amino-1,2-diphenylethyl)-p-toluenesulfonamide": 'Cc1ccc(cc1)S(=O)(=O)N[C@@H]([C@@H](c1ccccc1)N)c1ccccc1' "(S)-(+)-1,1'-Binaphthyl-2,2'-diyl Bis(trifluoromethanesulfonate)": 'O=S(=O)(C(F)(F)F)Oc1ccc2c(c1c1c(ccc3c1cccc3)OS(=O)(=O)C(F)(F)F)cccc2' "(S)-(+)-1,1'-Binaphthyl-2,2'-diyl Hydrogen Phosphate": 'OP1(=O)Oc2ccc3c(c2-c2c(O1)ccc1c2cccc1)cccc3' "(S)-(+)-1-(2-Pyrrolidinylmethyl)pyrrolidine": 'C1CCN(C1)C[C@@H]1CCCN1' "(S)-(+)-2-(Anilinomethyl)pyrrolidine": 'C1CN[C@@H](C1)CNc1ccccc1' "(S)-(+)-2-[Hydroxy(diphenyl)methyl]-1-methylpyrrolidine": 'CN1CCC[C@H]1C(c1ccccc1)(c1ccccc1)O' "(S)-(+)-4-Benzyl-3-propionyl-2-oxazolidinone": 'CCC(=O)N1C(=O)OC[C@@H]1Cc1ccccc1' "(S)-(+)-4-Isopropyl-3-propionyl-2-oxazolidinone": 'CCC(=O)N1C(=O)OC[C@@H]1C(C)C' "(S)-(+)-4-Phenyl-2-oxazolidinone": 'O=C1OC[C@@H](N1)c1ccccc1' "(S)-(+)-6,6'-Dibromo-1,1'-bi-2-naphthol": 'Brc1ccc2c(c1)ccc(c2c1c(O)ccc2c1ccc(c2)Br)O' "(S)-(+)-p-Toluenesulfinamide": 'Cc1ccc(cc1)[S@](=O)N' "(S)-(-)-,-Diphenyl-2-pyrrolidinemethanol": 'OC(c1ccccc1)(c1ccccc1)[C@@H]1CCCN1' "(S)-(-)-,-Diphenyl-2-pyrrolidinemethanol Trimethylsilyl Ether": 'C[Si](OC(c1ccccc1)(c1ccccc1)[C@@H]1CCCN1)(C)C' "(S)-(-)-1,1'-Bi-2-naphthol": 'Oc1ccc2c(c1c1c(O)ccc3c1cccc3)cccc2' "(S)-(-)-1,1'-Binaphthyl-2,2'-diamine": 'Nc1ccc2c(c1c1c(N)ccc3c1cccc3)cccc2' "(S)-(-)-1-Methyl-2-(1-piperidinomethyl)pyrrolidine": 'CN1CCC[C@H]1CN1CCCCC1' "(S)-(-)-2-(Diphenylmethyl)pyrrolidine": 'C1CN[C@@H](C1)C(c1ccccc1)c1ccccc1' "(S)-(-)-2-Amino-2'-hydroxy-1,1'-binaphthyl": 'Oc1ccc2c(c1c1c(N)ccc3c1cccc3)cccc2' "(S)-(-)-2-Aminomethyl-1-ethylpyrrolidine": 'NC[C@@H]1CCCN1CC' "(S)-(-)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-1,1'-bi-2-naphthol": 'Brc1cc2CCCCc2c(c1O)c1c(O)c(Br)cc2c1CCCC2' "(S)-(-)-3-(tert-Butoxycarbonyl)-4-formyl-2,2-dimethyl-1,3-oxazolidine": 'O=C[C@@H]1COC(N1C(=O)OC(C)(C)C)(C)C' "(S)-(-)-3-tert-Butoxycarbonyl-4-methoxycarbonyl-2,2-dimethyl-1,3-oxazolidine": 'COC(=O)[C@@H]1COC(N1C(=O)OC(C)(C)C)(C)C' "(S)-(-)-5,5',6,6',7,7',8,8'-Octahydro-1,1'-bi-2-naphthol": 'Oc1ccc2c(c1c1c(O)ccc3c1CCCC3)CCCC2' "(S)-(-)-BINAP": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1' "(S)-(-)-Indoline-2-carboxylic Acid": 'OC(=O)[C@@H]1Cc2c(N1)cccc2' "(S)-(-)-N,N-Dimethyl-1-ferrocenylethylamine": 'CN(C)[C@H](c1cccc1)C.[Del][Fe][Del].c2cccc2' "(S)-(-)-tert-Butylsulfinamide": 'CC([S@](=O)N)(C)C' "(S)-(4-Isopropyloxazolin-2-yl)ferrocene": 'CC(C)[C@H]1COC(c2cccc2)=N1.[Del][Fe][Del].c3cccc3' "(S)-1-(Diphenylphosphino)-2-[(S)-4-isopropyloxazolin-2-yl]ferrocene": 'CC(C)[C@@H]1N=C(c2c(P(C3=CC=CC=C3)C4=CC=CC=C4)ccc2)OC1.[Del][Fe][Del].c5cccc5' "(S)-2,2'-Dimethoxy-1,1'-binaphthyl": 'COc1ccc2c(c1c1c(OC)ccc3c1cccc3)cccc2' "(S)-2,4-Diphenyl-4,5-dihydrooxazole": 'c1ccc(cc1)[C@H]1COC(=N1)c1ccccc1' "(S)-2-(Aminomethyl)pyrrolidine": 'NC[C@@H]1CCCN1' "(S)-2-(Methoxymethyl)pyrrolidine": 'COC[C@@H]1CCCN1' "(S)-2-[(1-Methyl-2-pyrrolidinyl)methyl]isoindoline Dihydrochloride": 'CN1CCC[C@H]1CN1Cc2c(C1)cccc2.Cl.Cl' "(S)-3,3'-Dibromo-1,1'-bi-2-naphthol": 'Brc1cc2ccccc2c(c1O)c1c(O)c(Br)cc2c1cccc2' "(S)-3,3'-Dibromo-2,2'-dimethoxy-1,1'-binaphthyl": 'COc1c(Br)cc2c(c1c1c(OC)c(Br)cc3c1cccc3)cccc2' "(S)-3-[1-(4-Methoxybenzenesulfonyl)-(4S,5S)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]-1,1'-binaphthalene-2,2'-diyl Hydrogen Phosphate": 'COc1ccc(cc1)S(=O)(=O)N1C(=N[C@H]([C@@H]1c1ccccc1)c1ccccc1)c1cc2ccccc2c2-c3c(OP(=O)(Oc12)O)ccc1c3cccc1' "(S)-4-(4-Aminobenzyl)-2-oxazolidinone": 'O=C1OC[C@@H](N1)Cc1ccc(cc1)N' "(S)-4-Benzyl-2-oxazolidinone": 'O=C1OC[C@@H](N1)Cc1ccccc1' "(S)-4-Isopropyl-2-oxazolidinone": 'CC([C@H]1COC(=O)N1)C' "(S)-4-Isopropyl-3-(1-naphthylmethyl)-2,5,5-triphenyl-1,3,2-oxazaborolidine": 'CC([C@@H]1N(Cc2cccc3c2cccc3)B(OC1(c1ccccc1)c1ccccc1)c1ccccc1)C' "(S)-4-Isopropylthiazolidine-2-thione": 'CC([C@H]1CSC(=S)N1)C' "(S)-4-Phenylthiazolidine-2-thione": 'S=C1SC[C@@H](N1)c1ccccc1' "(S)-4-tert-Butyl-2-(2-pyridyl)oxazoline": 'CC([C@H]1COC(=N1)c1ccccn1)(C)C' "(S)-5,5-Diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine": 'CB1OC([C@H]2N1CCC2)(c1ccccc1)c1ccccc1' "(S)-5-(Pyrrolidin-2-yl)-1H-tetrazole": 'C1CN[C@@H](C1)c1nnn[nH]1' "(S)-AB": 'CC[C@@H](CO)N' "(S)-Benzyl-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate": 'FC(c1ccc(cc1)[n+]1nc2n(c1Cc1ccccc1)CCC2)(F)F.F[B-](F)(F)F' "(S)-N,N-Dimethyl-1-[(R)-1',2-bis(diphenylphosphino)ferrocenyl]ethylamine": 'C[C@@H](N(C)C)c1c(P(C2=CC=CC=C2)C3=CC=CC=C3)ccc1.[Del][Fe][Del].c4(P(C5=CC=CC=C5)C6=CC=CC=C6)cccc4' "(S)-N,N-Dimethyl-1-[(R)-2-(diphenylphosphino)ferrocenyl]ethylamine": 'CN(C)[C@@H](CP(C1=CC=CC=C1)C2=CC=CC=C2)c3cccc3.[Del][Fe][Del].c4cccc4' "(S,S'')-2,2''-Bis[(S)-4-isopropyloxazolin-2-yl]-1,1''-biferrocene": 'CC(C)[C@H]1OC(c2c(c3cccc3C4=N[C@@H](C(C)C)CO4)ccc2)=NC1.[Del][Fe][Del].[Del][Fe][Del].c5cccc5.c6cccc6' "(S,S)-(+)-2,3-Bis(tert-butylmethylphosphino)quinoxaline": 'CP(C(C)(C)C)c1nc2ccccc2nc1P(C(C)(C)C)C' "(S,S)-(+)-2,3-Dimethoxy-1,4-bis(dimethylamino)butane": 'CO[C@H]([C@H](CN(C)C)OC)CN(C)C' "(S,S)-(-)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline)": 'CC(C1=N[C@H](CO1)C(C)(C)C)(C1=N[C@H](CO1)C(C)(C)C)C' "(S,S)-1,2-Bis[(2-methoxyphenyl)phenylphosphino]ethane": 'COc1ccccc1P(c1ccccc1)CCP(c1ccccc1OC)c1ccccc1' "(S,S)-1,2-Bis[(tert-butyl)methylphosphino]ethane Bis(borane)": 'CP(C(C)(C)C)CCP(C(C)(C)C)C.B.B' "(S,S)-2,2'-Isopropylidenebis(4-phenyl-2-oxazoline)": 'CC(C1=N[C@H](CO1)c1ccccc1)(C1=N[C@H](CO1)c1ccccc1)C' "(S,S)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine": 'CC([C@H]1COC(=N1)c1cccc(n1)C1=N[C@H](CO1)C(C)C)C' "(S,S)-2,6-Bis(4-phenyl-2-oxazolin-2-yl)pyridine": 'C1OC(=N[C@H]1c1ccccc1)c1cccc(n1)C1=N[C@H](CO1)c1ccccc1' "(S,S)-4,6-Bis(4-isopropyl-2-oxazolin-2-yl)-m-xylene": 'CC([C@H]1COC(=N1)c1cc(c(cc1C)C)C1=N[C@H](CO1)C(C)C)C' "(S,S)-N-(2-Amino-1,2-diphenylethyl)-p-toluenesulfonamide": 'Cc1ccc(cc1)S(=O)(=O)N[C@H]([C@H](c1ccccc1)N)c1ccccc1' "(Trifluoroacetyl)benzotriazole": 'O=C(C(F)(F)F)c1cccc2c1nn[nH]2' "(Trifluoromethyl)trimethylsilane": 'FC([Si](C)(C)C)(F)F' "(Trifluoromethyl)tris(triphenylphosphine)copper(I)": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.FC([Cu])(F)F' "(Triphenylphosphine)gold(I) Chloride": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Cl-].[Au+]' "(m-Terphenyl-5'-yl)trimethylsilane": 'C[Si](c1cc(cc(c1)c1ccccc1)c1ccccc1)(C)C' "(tert-Butyldimethylsilyl)acetylene": 'C#C[Si](C(C)(C)C)(C)C' "(tert-Butyldimethylsilyloxy)malononitrile": 'N#CC(O[Si](C(C)(C)C)(C)C)C#N' "-Isocupreidine": 'CC[C@@]12C[N@@]3CC[C@H]2C[C@@H]3[C@@H](O1)c1ccnc2c1cc(O)cc2' "-Methyl-L-proline": 'OC(=O)[C@]1(C)CCCN1' "1,1'-(2,6-Pyridinediyl)bis(3-methylimidazolium) Dibromide": 'C[n+]1ccn(c1)c1cccc(n1)n1cc[n+](c1)C.[Br-].[Br-]' "1,1'-Bi-2-naphthol": 'Oc1ccc2c(c1c1c(O)ccc3c1cccc3)cccc2' "1,1'-Bis(di-tert-butylphosphino)ferrocene": 'CC(C)(C)P(c1cccc1)C(C)(C)C.CC(C)(C)P(c2cccc2)C(C)(C)C.[Del][Fe][Del]' "1,1'-Bis(dichlorophosphino)ferrocene": 'ClP(Cl)c1cccc1.ClP(Cl)c2cccc2.[Del][Fe][Del]' "1,1'-Bis(diisopropylphosphino)ferrocene": 'CC(C)P(c1cccc1)C(C)C.CC(C)P(c2cccc2)C(C)C.[Del][Fe][Del]' "1,1'-Bis(diphenylphosphino)ferrocene": '[Del][Fe][Del].c1(P(C2=CC=CC=C2)C3=CC=CC=C3)cccc1.c4(P(C5=CC=CC=C5)C6=CC=CC=C6)cccc4' "1,1'-Carbonyldi(1,2,4-triazole)": 'O=C(n1ncnc1)n1ncnc1' "1,1'-Carbonyldiimidazole": 'O=C(n1cncc1)n1cncc1' "1,1'-Difluoro-2,2'-bipyridinium Bis(tetrafluoroborate)": 'F[B-](F)(F)F.F[B-](F)(F)F.F[n+]1ccccc1c1cccc[n+]1F' "1,1'-Oxalyldiimidazole": 'O=C(C(=O)n1cncc1)n1cncc1' "1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate": 'FC(C(C(F)(F)F)OS(=O)(=O)C(F)(F)F)(F)F' "1,1,1,3,3-Pentamethyldisiloxane": 'C[SiH](O[Si](C)(C)C)C' "1,1,1,3,5,5,5-Heptamethyl-3-[(trimethylsilyl)oxy]trisiloxane": 'C[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C' "1,1,1,3,5,5,5-Heptamethyltrisiloxane": 'C[SiH](O[Si](C)(C)C)O[Si](C)(C)C' "1,1,1,3,5,7,7,7-Octamethyltetrasiloxane": 'C[SiH](O[Si](C)(C)C)O[SiH](O[Si](C)(C)C)C' "1,1,1,5,5,5-Hexamethyl-3-[(trimethylsilyl)oxy]-3-vinyltrisiloxane": 'C=C[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C' "1,1,1,5,5,5-Hexamethyl-3-phenyl-3-(trimethylsilyloxy)trisiloxane": 'C[Si](O[Si](c1ccccc1)(O[Si](C)(C)C)O[Si](C)(C)C)(C)C' "1,1,2,2-Tetrachloro-1,2-dimethyldisilane": 'C[Si]([Si](Cl)(Cl)C)(Cl)Cl' "1,1,2,2-Tetraphenyldisilane": 'c1ccc(cc1)[SiH]([SiH](c1ccccc1)c1ccccc1)c1ccccc1' "1,1,2,3,4,5-Hexaphenylsilole": 'c1ccc(cc1)C1=C(c2ccccc2)[Si](C(=C1c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1' "1,1,3,3,5,5,7,7,9,9,11,11,13,13-Tetradecamethylheptasiloxane": 'C[SiH](O[Si](O[Si](O[Si](O[Si](O[Si](O[SiH](C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C' "1,1,3,3,5,5,7,7,9,9,11,11-Dodecamethylhexasiloxane": 'C[SiH](O[Si](O[Si](O[Si](O[Si](O[SiH](C)C)(C)C)(C)C)(C)C)(C)C)C' "1,1,3,3,5,5-Hexaethoxy-1,3,5-trisilacyclohexane": 'CCO[Si]1(OCC)C[Si](OCC)(OCC)C[Si](C1)(OCC)OCC' "1,1,3,3,5,5-Hexamethyltrisiloxane": 'C[SiH](O[Si](O[SiH](C)C)(C)C)C' "1,1,3,3-Tetramethyl-1,3-diphenyldisiloxane": 'C[Si](c1ccccc1)(O[Si](c1ccccc1)(C)C)C' "1,1,3,3-Tetramethyldisiloxane": 'C[SiH](O[SiH](C)C)C' "1,1,3,3-Tetramethylguanidine": 'CN(C(=N)N(C)C)C' "1,1,4,7,10,10-Hexamethyltriethylenetetramine": 'CN(CCN(C)C)CCN(CCN(C)C)C' "1,1,5,5-Tetrafluoro-2,4-pentanedione": 'FC(C(=O)CC(=O)C(F)F)F' "1,1-Dimethyl-1,3-dihydrobenzo[c][1,2]oxasilole": 'C[Si]1(C)OCc2c1cccc2' "1,10-Phenanthroline Monohydrate": 'c1ccc2c(n1)c1ncccc1cc2.O' "1,10-Phenanthroline-5,6-dione": 'O=C1C(=O)c2cccnc2-c2c1cccn2' "1,2,3,4,5-Pentamethylcyclopentadiene": 'CC1C(=C(C(=C1C)C)C)C' "1,2,3,4,5-Pentaphenyl-1'-(di-tert-butylphosphino)ferrocene": 'CC(C)(C)P(C(C)(C)C)c1cccc1.[Del][Fe][Del].c2(C3=CC=CC=C3)c(C4=CC=CC=C4)c(C5=CC=CC=C5)c(C6=CC=CC=C6)c2C7=CC=CC=C7' "1,2,3,4,5-Pentaphenyl-1,3-cyclopentadiene": 'c1ccc(cc1)C1C(=C(C(=C1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1' "1,2,3,4-Tetrahydroquinoline": 'C1CCc2c(N1)cccc2' "1,2,3,4-Tetraphenyl-1,3-cyclopentadiene": 'c1ccc(cc1)C1=C(c2ccccc2)C(=C(C1)c1ccccc1)c1ccccc1' "1,2,4-Triazole": 'c1ncn[nH]1' "1,2-Benzenedisulfonic Imide": 'O=S1(=O)NS(=O)(=O)c2c1cccc2' "1,2-Bis(3-indenyl)ethane": 'c1ccc2c(c1)C(=CC2)CCC1=CCc2c1cccc2' "1,2-Bis(4'-methyl-2,2'-bipyridin-4-yl)ethane": 'Cc1ccnc(c1)c1nccc(c1)CCc1ccnc(c1)c1nccc(c1)C' "1,2-Bis(dimethylphosphino)ethane": 'CP(CCP(C)C)C' "1,2-Bis(diphenylphosphino)benzene": 'c1ccc(c(c1)P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1' "1,2-Bis(diphenylphosphino)ethane": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1' "1,2-Bis(phenylsulfinyl)ethane Palladium(II) Diacetate": 'O=S(c1ccccc1)CCS(=O)c1ccccc1.[O-]C(=O)C.[O-]C(=O)C.[Pd+2]' "1,2-Bis(tert-butylthio)ethane Borane": 'CC(SCCSC(C)(C)C)(C)C.B' "1,2-Bis(trichlorosilyl)ethane": 'Cl[Si](CC[Si](Cl)(Cl)Cl)(Cl)Cl' "1,2-Bis(triethoxysilyl)ethane": 'CCO[Si](OCC)(OCC)CC[Si](OCC)(OCC)OCC' "1,2-Bis(trimethylsilyl)benzene": 'C[Si](c1ccccc1[Si](C)(C)C)(C)C' "1,2-Bis[bis(pentafluorophenyl)phosphino]ethane": 'Fc1c(P(c2c(F)c(F)c(c(c2F)F)F)CCP(c2c(F)c(F)c(c(c2F)F)F)c2c(F)c(F)c(c(c2F)F)F)c(F)c(c(c1F)F)F' "1,2-Dibromo-1,1,2,2-tetrachloroethane": 'ClC(C(Br)(Cl)Cl)(Br)Cl' "1,2-Dichlorethane": 'ClCCCl' "1,2-Dichlorotetramethyldisilane": 'C[Si]([Si](Cl)(C)C)(Cl)C' "1,2-Dimethyl-3-propylimidazolium Iodide": 'CCC[n+]1ccn(c1C)C.[I-]' "1,2-Phenylenediamine": 'Nc1ccccc1N' "1,3,5,7-Cyclooctatetraene": 'C1=CC=CC=CC=C1' "1,3,5,7-Cyclooctatetraene (stabilized with HQ)": 'C1=CC=CC=CC=C1' "1,3,5-Cycloheptatriene": 'C1=CC=CC=CC1' "1,3,5-Trimethylbenzene": 'Cc1cc(C)cc(c1)C' "1,3,5-Tris(3,3,3-trifluoropropyl)-1,3,5-trimethylcyclotrisiloxane": 'FC(CC[Si]1(C)O[Si](C)(CCC(F)(F)F)O[Si](O1)(C)CCC(F)(F)F)(F)F' "1,3-Bis(2,4,6-trimethylphenyl)imidazolinium Chloride": 'Cc1cc(C)c(c(c1)C)N1CC[N+](=C1)c1c(C)cc(cc1C)C.[Cl-]' "1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide": 'CC(c1cccc(c1N1CCN(P1=O)c1c(cccc1C(C)C)C(C)C)C(C)C)C' "1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene": 'CC(c1cccc(c1N1C=CN([C]1)c1c(cccc1C(C)C)C(C)C)C(C)C)C' "1,3-Bis(2,6-diisopropylphenyl)imidazolidin-2-ylidene": 'CC(c1cccc(c1N1CCN([C]1)c1c(cccc1C(C)C)C(C)C)C(C)C)C' "1,3-Bis(2,6-diisopropylphenyl)imidazolinium Chloride": 'CC(c1cccc(c1N1CC[N+](=C1)c1c(cccc1C(C)C)C(C)C)C(C)C)C.[Cl-]' "1,3-Bis(2,6-diisopropylphenyl)imidazolium Chloride": 'CC(c1cccc(c1n1cc[n+](c1)c1c(cccc1C(C)C)C(C)C)C(C)C)C.[Cl-]' "1,3-Bis(4-hydroxybutyl)tetramethyldisiloxane": 'OCCCC[Si](O[Si](CCCCO)(C)C)(C)C' "1,3-Bis(4-methoxyphenyl)-1,3-propanedione": 'COc1ccc(cc1)C(=O)CC(=O)c1ccc(cc1)OC' "1,3-Bis(chloromethyl)tetramethyldisiloxane": 'ClC[Si](O[Si](CCl)(C)C)(C)C' "1,3-Bis(diphenylphosphino)propane": 'C(CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1' "1,3-Bis[(di-tert-butylphosphino)oxy]benzene": 'CC(P(C(C)(C)C)Oc1cccc(c1)OP(C(C)(C)C)C(C)(C)C)(C)C' "1,3-Bis[(trimethylsilyl)ethynyl]benzene": 'C[Si](C#Cc1cccc(c1)C#C[Si](C)(C)C)(C)C' "1,3-Di(1-adamantyl)imidazolinium Tetrafluoroborate": 'C1C2CC3CC1CC(C2)(C3)N1CC[N+](=C1)C12CC3CC(C2)CC(C1)C3.F[B-](F)(F)F' "1,3-Di(1-adamantyl)imidazolium Tetrafluoroborate": 'C1C2CC3CC1CC(C2)(C3)n1cc[n+](c1)C12CC3CC(C2)CC(C1)C3.F[B-](F)(F)F' "1,3-Di(2-pyridyl)-1,3-propanedione": 'O=C(c1ccccn1)CC(=O)c1ccccn1' "1,3-Di-tert-butylimidazol-2-ylidene": 'CC(N1C=CN([C]1)C(C)(C)C)(C)C' "1,3-Di-tert-butylimidazolium Tetrafluoroborate": 'CC(n1cc[n+](c1)C(C)(C)C)(C)C.F[B-](F)(F)F' "1,3-Dibromo-5,5-dimethylhydantoin": 'BrN1C(=O)N(C(C1=O)(C)C)Br' "1,3-Dicyclohexylimidazolium Tetrafluoroborate": 'C1CCC(CC1)n1cc[n+](c1)C1CCCCC1.F[B-](F)(F)F' "1,3-Diiodo-5,5-dimethylhydantoin": 'IN1C(=O)N(C(C1=O)(C)C)I' "1,3-Diisopropylimidazolinium Tetrafluoroborate": 'F[B-](F)(F)F.CC(N1CC[N+](=C1)C(C)C)C' "1,3-Diisopropylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CC(n1cc[n+](c1)C(C)C)C' "1,3-Dimesitylimidazol-2-ylidene": 'Cc1cc(C)cc(c1N1C=CN([C]1)c1c(C)cc(cc1C)C)C' "1,3-Dimesitylimidazolium Chloride": 'Cc1cc(C)c(c(c1)C)n1cc[n+](c1)c1c(C)cc(cc1C)C.[Cl-]' "1,3-Dimethoxy-1,1,3,3-tetraphenyldisiloxane": 'CO[Si](c1ccccc1)(c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)OC' "1,3-Dimethylimidazolium Chloride": 'Cn1cc[n+](c1)C.[Cl-]' "1,3-Dimethylimidazolium Dimethyl Phosphate": 'Cn1cc[n+](c1)C.COP(=O)(OC)[O-]' "1,3-Dimethylimidazolium Iodide": 'Cn1cc[n+](c1)C.[I-]' "1,3-Dimethylimidazolium Methyl Sulfate": 'Cn1cc[n+](c1)C.COS(=O)(=O)[O-]' "1,3-Diphenyl-1,3-propanedione": 'O=C(c1ccccc1)CC(=O)c1ccccc1' "1,3-Divinyltetramethyldisiloxane": 'C=C[Si](O[Si](C=C)(C)C)(C)C' "1,4,7,10,13,16-Hexaazacyclooctadecane": 'N1CCNCCNCCNCCNCCNCC1' "1,4,7,10,13,16-Hexaazacyclooctadecane Hexahydrochloride": 'N1CCNCCNCCNCCNCCNCC1.Cl.Cl.Cl.Cl.Cl.Cl' "1,4,7,10-Tetraazacyclododecane": 'N1CCNCCNCCNCC1' "1,4,7,10-Tetraazacyclododecane Tetrahydrochloride": 'N1CCNCCNCCNCC1.Cl.Cl.Cl.Cl' "1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic Acid": 'OC(=O)CN1CCN(CCN(CCN(CC1)CC(=O)O)CC(=O)O)CC(=O)O' "1,4,7,10-Tetrabenzyl-1,4,7,10-tetraazacyclododecane": 'c1ccc(cc1)CN1CCN(CCN(CCN(CC1)Cc1ccccc1)Cc1ccccc1)Cc1ccccc1' "1,4,7-Triazacyclononane": 'N1CCNCCNCC1' "1,4,7-Trimethyl-1,4,7-triazacyclononane (stabilized with NaHCO3)": 'CN1CCN(C)CCN(CC1)C' "1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane": 'CN1CCCN(C)CCN(CCCN(CC1)C)C' "1,4-Bis(dimethylsilyl)benzene": 'C[SiH](c1ccc(cc1)[SiH](C)C)C' "1,4-Bis(diphenylphosphino)butane": 'C(CP(c1ccccc1)c1ccccc1)CCP(c1ccccc1)c1ccccc1' "1,4-Bis(trimethylsilyl)-1,3-butadiyne": 'C[Si](C#CC#C[Si](C)(C)C)(C)C' "1,4-Cyclohexadiene": 'C1=CCC=CC1' "1,4-Cyclohexadiene (stabilized with BHT)": 'C1=CCC=CC1' "1,4-Diazabicyclo[2.2.2]octane": 'C1CN2CCN1CC2' "1,4-Dimethyl-1,2,4-triazolium Iodide": 'Cn1cn[n+](c1)C.[I-]' "1,5,7-Triazabicyclo[4.4.0]dec-5-ene": 'C1CNC2=NCCCN2C1' "1,5,9-Triazacyclododecane": 'C1CCNCCCNCCCN1' "1,5-Bis(diphenylphosphino)pentane": 'C(CCP(c1ccccc1)c1ccccc1)CCP(c1ccccc1)c1ccccc1' "1,5-Cyclooctadiene [stabilized with Octadecyl 3-(3',5'-Di-tert-butyl-4'-hydroxyphenyl)propionate]": 'C1CC=CCCC=C1' "1,5-Diazabicyclo[4.3.0]-5-nonene": 'C1CN=C2N(C1)CCC2' "1,5-Dichloro-1,1,3,3,5,5-hexamethyltrisiloxane": 'C[Si](O[Si](Cl)(C)C)(O[Si](Cl)(C)C)C' "1,5-Dimethyl-2,4-bis[2-(trimethylsilyl)ethynyl]benzene": 'Cc1cc(C)c(cc1C#C[Si](C)(C)C)C#C[Si](C)(C)C' "1,5-Hexadiene": 'C=CCCC=C' "1,6-Bis(diphenylphosphino)hexane": 'C(CCP(c1ccccc1)c1ccccc1)CCCP(c1ccccc1)c1ccccc1' "1,7-Dichloro-1,1,3,3,5,5,7,7-octamethyltetrasiloxane": 'C[Si](O[Si](Cl)(C)C)(O[Si](O[Si](Cl)(C)C)(C)C)C' "1,8-Bis(dimethylamino)naphthalene": 'CN(c1cccc2c1c(ccc2)N(C)C)C' "1,8-Bis(diphenylphosphino)naphthalene": 'c1ccc(cc1)P(c1cccc2c1c(ccc2)P(c1ccccc1)c1ccccc1)c1ccccc1' "1,8-Diazabicyclo[5.4.0]-7-undecene": 'C1CCN2C(=NCCC2)CC1' "1,8-Diazabicyclo[5.4.0]-7-undecene Hydrogen Tribromide": 'C1CCN2C(=NCCC2)CC1.[H+].[Br-].[Br-].[Br-]' "1-(2,4,6-Triisopropylbenzenesulfonyl)-1,2,4-triazole": 'CC(c1cc(cc(c1S(=O)(=O)n1cncn1)C(C)C)C(C)C)C' "1-(2,4,6-Triisopropylbenzenesulfonyl)imidazole": 'CC(c1cc(cc(c1S(=O)(=O)n1cncc1)C(C)C)C(C)C)C' "1-(2-Hydroxyethyl)-3-methylimidazolium Chloride": 'OCCn1cc[n+](c1)C.[Cl-]' "1-(2-Hydroxyethyl)-3-methylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.OCCn1cc[n+](c1)C' "1-(2-Mesitylene)-1,3-butanedione": 'CC(=O)CC(=O)c1c(C)cc(cc1C)C' "1-(2-Mesitylenesulfonyl)imidazole": 'Cc1cc(C)c(c(c1)C)S(=O)(=O)n1cncc1' "1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide": 'CCN=C=NCCCN(C)C' "1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide Hydrochloride": 'CCN=C=NCCCN(C)C.Cl' "1-(4-Bromophenyl)-1,3-butanedione": 'O=C(c1ccc(cc1)Br)CC(=O)C' "1-(4-Chlorophenyl)-4,4,4-trifluoro-1,3-butanedione": 'O=C(c1ccc(cc1)Cl)CC(=O)C(F)(F)F' "1-(4-Fluorophenyl)-1,3-butanedione": 'O=C(c1ccc(cc1)F)CC(=O)C' "1-(4-tert-Butylphenyl)-3-(4-methoxyphenyl)-1,3-propanedione": 'COc1ccc(cc1)C(=O)CC(=O)c1ccc(cc1)C(C)(C)C' "1-(Chloro-1-pyrrolidinylmethylene)pyrrolidinium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.ClC(=[N+]1CCCC1)N1CCCC1' "1-(Chloro-1-pyrrolidinylmethylene)pyrrolidinium Tetrafluoroborate": 'F[B-](F)(F)F.ClC(=[N+]1CCCC1)N1CCCC1' "1-(Cyanomethyl)piperidinium Tetrafluoroborate": 'F[B-](F)(F)F.N#CC[NH+]1CCCCC1' "1-(Heptafluorobutyryl)imidazole": 'O=C(C(C(C(F)(F)F)(F)F)(F)F)n1cncc1' "1-(Trifluoroacetyl)-4-(dimethylamino)pyridinium Trifluoroacetate": '[O-]C(=O)C(F)(F)F.CN(c1cc[n+](cc1)C(=O)C(F)(F)F)C' "1-(Trifluoroacetyl)imidazole": 'O=C(C(F)(F)F)n1cncc1' "1-(Trifluoroacetyl)piperidine": 'O=C(C(F)(F)F)N1CCCCC1' "1-(Trifluoromethanesulfonyl)-1H-benzotriazole": 'O=S(=O)(C(F)(F)F)n1nnc2c1cccc2' "1-(Trifluoromethanesulfonyl)imidazole": 'O=S(=O)(C(F)(F)F)n1cncc1' "1-(Triisopropylsilyl)-1-propyne": 'CC#C[Si](C(C)C)(C(C)C)C(C)C' "1-(Trimethoxysilyl)naphthalene": 'CO[Si](c1cccc2c1cccc2)(OC)OC' "1-(Trimethylsilyl)-1-pentyne": 'CCCC#C[Si](C)(C)C' "1-(Trimethylsilyl)-1-propyne": 'CC#C[Si](C)(C)C' "1-(p-Toluenesulfonyl)imidazole": 'Cc1ccc(cc1)S(=O)(=O)n1cncc1' "1-Acetoxy-5-bromo-1,2-benziodoxol-3(1H)-one": 'CC(=O)O[I]1OC(=O)c2c1ccc(c2)Br' "1-Allyl-3-methylimidazolium Chloride": 'C=CCn1cc[n+](c1)C.[Cl-]' "1-Bromo-3-(trimethylsilyl)benzene": 'Brc1cccc(c1)[Si](C)(C)C' "1-Bromo-4-(trimethylsilyl)benzene": 'Brc1ccc(cc1)[Si](C)(C)C' "1-Butyl-1-methylpiperidinium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCC[N+]1(C)CCCCC1' "1-Butyl-1-methylpiperidinium Bromide": 'CCCC[N+]1(C)CCCCC1.[Br-]' "1-Butyl-1-methylpyrrolidinium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCC[N+]1(C)CCCC1' "1-Butyl-1-methylpyrrolidinium Bromide": 'CCCC[N+]1(C)CCCC1.[Br-]' "1-Butyl-1-methylpyrrolidinium Chloride": 'CCCC[N+]1(C)CCCC1.[Cl-]' "1-Butyl-1-methylpyrrolidinium Dicyanamide": 'CCCC[N+]1(C)CCCC1.N#C[N-]C#N' "1-Butyl-1-methylpyrrolidinium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CCCC[N+]1(C)CCCC1' "1-Butyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCCn1cc[n+](c1C)C' "1-Butyl-2,3-dimethylimidazolium Chloride": 'CCCCn1cc[n+](c1C)C.[Cl-]' "1-Butyl-2,3-dimethylimidazolium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCCn1cc[n+](c1C)C' "1-Butyl-2,3-dimethylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CCCCn1cc[n+](c1C)C' "1-Butyl-2,3-dimethylimidazolium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CCCCn1cc[n+](c1C)C' "1-Butyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Bromide": 'CCCCn1cc[n+](c1)C.[Br-]' "1-Butyl-3-methylimidazolium Chloride": 'CCCCn1cc[n+](c1)C.[Cl-]' "1-Butyl-3-methylimidazolium Dicyanamide": 'CCCCn1cc[n+](c1)C.N#C[N-]C#N' "1-Butyl-3-methylimidazolium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Iodide": 'CCCCn1cc[n+](c1)C.[I-]' "1-Butyl-3-methylimidazolium Methanesulfonate": '[O-]S(=O)(=O)C.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Methyl Sulfate": 'COS(=O)(=O)[O-].CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Tetrachloroferrate": 'Cl[Fe-](Cl)(Cl)Cl.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Thiocyanate": 'CCCCn1cc[n+](c1)C.[S-]C#N' "1-Butyl-3-methylimidazolium Tribromide": 'CCCCn1cc[n+](c1)C.[Br-].[Br-].[Br-]' "1-Butyl-3-methylimidazolium Tricyanomethanide": 'N#C[C-](C#N)C#N.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Trifluoro(trifluoromethyl)borate": 'FC([B-](F)(F)F)(F)F.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Trifluoroacetate": '[O-]C(=O)C(F)(F)F.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylimidazolium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CCCCn1cc[n+](c1)C' "1-Butyl-3-methylpyridinium Bromide": 'CCCC[n+]1cccc(c1)C.[Br-]' "1-Butyl-3-methylpyridinium Chloride": 'CCCC[n+]1cccc(c1)C.[Cl-]' "1-Butyl-4-methylpyridinium Bromide": 'CCCC[n+]1ccc(cc1)C.[Br-]' "1-Butyl-4-methylpyridinium Chloride": 'CCCC[n+]1ccc(cc1)C.[Cl-]' "1-Butyl-4-methylpyridinium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCC[n+]1ccc(cc1)C' "1-Butylpyridinium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCC[n+]1ccccc1' "1-Butylpyridinium Bromide": 'CCCC[n+]1ccccc1.[Br-]' "1-Butylpyridinium Chloride": 'CCCC[n+]1ccccc1.[Cl-]' "1-Butylpyridinium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCC[n+]1ccccc1' "1-Butylpyridinium Tetrafluoroborate": 'F[B-](F)(F)F.CCCC[n+]1ccccc1' "1-Chloro-2-iodoethane": 'ClCCI' "1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide Metho-p-toluenesulfonate": 'C[N+]1(CCOCC1)CCN=C=NC1CCCCC1.Cc1ccc(cc1)S(=O)(=O)[O-]' "1-Cyclopentenylboronic Acid": 'OB(C1=CCCC1)O' "1-Decyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCCCCCCCCn1cc[n+](c1)C' "1-Decyl-3-methylimidazolium Bromide": 'CCCCCCCCCCn1cc[n+](c1)C.[Br-]' "1-Decyl-3-methylimidazolium Chloride": 'CCCCCCCCCCn1cc[n+](c1)C.[Cl-]' "1-Ethoxycarbonyl-2-ethoxy-1,2-dihydroquinoline": 'CCOC(=O)N1C(OCC)C=Cc2c1cccc2' "1-Ethyl-1-methylpyrrolidinium Bromide": 'CC[N+]1(C)CCCC1.[Br-]' "1-Ethyl-1-methylpyrrolidinium Tetrafluoroborate": 'F[B-](F)(F)F.CC[N+]1(C)CCCC1' "1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCn1cc[n+](c1C)C' "1-Ethyl-2-methylpyridinium Bromide": 'CC[n+]1ccccc1C.[Br-]' "1-Ethyl-3-(hydroxymethyl)pyridinium Ethyl Sulfate": 'OCc1ccc[n+](c1)CC.CCOS(=O)(=O)[O-]' "1-Ethyl-3-methylimidazolium Acetate": '[O-]C(=O)C.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Bromide": 'CCn1cc[n+](c1)C.[Br-]' "1-Ethyl-3-methylimidazolium Chloride": 'CCn1cc[n+](c1)C.[Cl-]' "1-Ethyl-3-methylimidazolium Dicyanamide": 'CCn1cc[n+](c1)C.N#C[N-]C#N' "1-Ethyl-3-methylimidazolium Diethyl Phosphate": 'CCn1cc[n+](c1)C.CCOP(=O)(OCC)[O-]' "1-Ethyl-3-methylimidazolium Ethyl Sulfate": 'CCn1cc[n+](c1)C.CCOS(=O)(=O)[O-]' "1-Ethyl-3-methylimidazolium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Hydrogen Sulfate": '[O-]S(=O)(=O)O.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Iodide": 'CCn1cc[n+](c1)C.[I-]' "1-Ethyl-3-methylimidazolium Methanesulfonate": '[O-]S(=O)(=O)C.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Methyl Sulfate": 'COS(=O)(=O)[O-].CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Nitrate": '[O-][N+](=O)[O-].CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Tetrachloroferrate": 'Cl[Fe-](Cl)(Cl)Cl.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Thiocyanate": 'CCn1cc[n+](c1)C.[S-]C#N' "1-Ethyl-3-methylimidazolium Tricyanomethanide": 'N#C[C-](C#N)C#N.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Trifluoro(trifluoromethyl)borate": 'FC([B-](F)(F)F)(F)F.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Trifluoroacetate": '[O-]C(=O)C(F)(F)F.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazolium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CCn1cc[n+](c1)C' "1-Ethyl-3-methylimidazoliump-Toluenesulfonate": 'Cc1ccc(cc1)S(=O)(=O)[O-].CCn1cc[n+](c1)C' "1-Ethyl-3-methylpyridinium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CC[n+]1cccc(c1)C' "1-Ethyl-3-methylpyridinium Ethyl Sulfate": 'CC[n+]1cccc(c1)C.CCOS(=O)(=O)[O-]' "1-Ethyl-4-methylpyridinium Bromide": 'CC[n+]1ccc(cc1)C.[Br-]' "1-Ethylpyridinium Bromide": 'CC[n+]1ccccc1.[Br-]' "1-Ethylpyridinium Chloride": 'CC[n+]1ccccc1.[Cl-]' "1-Fluoro-2,4,6-trimethylpyridinium Tetrafluoroborate": 'F[B-](F)(F)F.Cc1cc(C)cc([n+]1F)C' "1-Fluoro-2,4,6-trimethylpyridinium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.Cc1cc(C)cc([n+]1F)C' "1-Fluoro-2,6-dichloropyridinium Tetrafluoroborate": 'F[B-](F)(F)F.F[n+]1c(Cl)cccc1Cl' "1-Fluoro-3,3-dimethyl-1,2-benziodoxole": 'F[I]1OC(c2c1cccc2)(C)C' "1-Fluoropyridinium Tetrafluoroborate": 'F[B-](F)(F)F.F[n+]1ccccc1' "1-Fluoropyridinium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.F[n+]1ccccc1' "1-Hexyl-2,3-dimethylimidazolium Iodide": 'CCCCCCn1cc[n+](c1C)C.[I-]' "1-Hexyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCCCCn1cc[n+](c1)C' "1-Hexyl-3-methylimidazolium Bromide": 'CCCCCCn1cc[n+](c1)C.[Br-]' "1-Hexyl-3-methylimidazolium Chloride": 'CCCCCCn1cc[n+](c1)C.[Cl-]' "1-Hexyl-3-methylimidazolium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCCCCn1cc[n+](c1)C' "1-Hexyl-3-methylimidazolium Iodide": 'CCCCCCn1cc[n+](c1)C.[I-]' "1-Hexyl-3-methylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CCCCCCn1cc[n+](c1)C' "1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CCCCCCn1cc[n+](c1)C' "1-Hexylpyridinium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCCCC[n+]1ccccc1' "1-Hydroxy-6-(trifluoromethyl)benzotriazole": 'On1nnc2c1cc(cc2)C(F)(F)F' "1-Methoxy-3-(trimethylsilyloxy)-1,3-butadiene": 'CO/C=C/C(=C)O[Si](C)(C)C' "1-Methyl-1-[4-(diphenylphosphino)benzyl]pyrrolidinium Bromide": 'C[N+]1(CCCC1)Cc1ccc(cc1)P(c1ccccc1)c1ccccc1.[Br-]' "1-Methyl-1-propylpiperidinium Bis(fluorosulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCC[N+]1(C)CCCCC1' "1-Methyl-1-propylpiperidinium Bromide": 'CCC[N+]1(C)CCCCC1.[Br-]' "1-Methyl-1-propylpyrrolidinium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)NS(=O)(=O)C(F)(F)F)(F)F.CCC[N+]1(C)CCCC1' "1-Methyl-3-n-octylimidazolium Bromide": 'CCCCCCCC[n+]1ccn(c1)C.[Br-]' "1-Methyl-3-n-octylimidazolium Chloride": 'CCCCCCCC[n+]1ccn(c1)C.[Cl-]' "1-Methyl-3-n-octylimidazolium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCCCCCC[n+]1ccn(c1)C' "1-Methyl-3-n-octylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CCCCCCCC[n+]1ccn(c1)C' "1-Methyl-3-n-octylimidazolium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CCCCCCCC[n+]1ccn(c1)C' "1-Methyl-3-pentylimidazolium Bromide": 'CCCCC[n+]1ccn(c1)C.[Br-]' "1-Methyl-3-pentylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CCCCC[n+]1ccn(c1)C' "1-Methyl-3-propylimidazolium Bromide": 'CCC[n+]1ccn(c1)C.[Br-]' "1-Methyl-3-propylimidazolium Chloride": 'CCC[n+]1ccn(c1)C.[Cl-]' "1-Methyl-3-propylimidazolium Iodide": 'CCC[n+]1ccn(c1)C.[I-]' "1-Methyl-3-propylimidazolium Tetrafluoroborate": 'F[B-](F)(F)F.CCC[n+]1ccn(c1)C' "1-Phenyl-1,3-butanedione": 'O=C(c1ccccc1)CC(=O)C' "1-Phenyl-2-(trimethylsilyl)acetylene": 'C[Si](C#Cc1ccccc1)(C)C' "1-Propylpyridinium Chloride": 'CCC[n+]1ccccc1.[Cl-]' "1-Trifluoromethyl-1,2-benziodoxol-3(1H)-one": 'O=C1O[I](c2c1cccc2)C(F)(F)F' "1-Trifluoromethyl-3,3-dimethyl-1,2-benziodoxole": 'FC([I]1OC(c2c1cccc2)(C)C)(F)F' "1-[2-(Di-tert-butylphosphino)phenyl]-3,5-diphenyl-1H-pyrazole": 'CC(P(C(C)(C)C)c1ccccc1n1nc(cc1c1ccccc1)c1ccccc1)(C)C' "1-[3-(Trimethoxysilyl)propyl]urea": 'CO[Si](CCCNC(=O)N)(OC)OC' "1-[Bis(trifluoromethanesulfonyl)methyl]-2,3,4,5,6-pentafluorobenzene": 'Fc1c(F)c(F)c(c(c1C(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F)F)F' "10-Methyl-9-phenylacridinium Perchlorate": '[O-][Cl](=O)(=O)=O.C[n+]1c2ccccc2c(c2c1cccc2)c1ccccc1' "10-Methylacridinium Perchlorate": '[O-][Cl](=O)(=O)=O.C[n+]1c2ccccc2cc2c1cccc2' "12-Crown-4": 'O1CCOCCOCCOCC1' "125I": 'I' "129Xe": '[Xe]' "12C": 'O=Cc1c(OCCCCC(=O)O)cccc1O' "18-crown-6": 'O1CCOCCOCCOCCOCCOCC1' "1H": '[HH]' "1H-Benzotriazol-1-yloxytripyrrolidinophosphonium Hexafluorophosphate": 'C1CCN(C1)[P+](N1CCCC1)(N1CCCC1)On1nnc2c1cccc2.F[P-](F)(F)(F)(F)F' "1H-Benzotriazol-1-yloxytris(dimethylamino)phosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN([P+](N(C)C)(N(C)C)On1nnc2c1cccc2)C' "1H-Cyclopenta[l]phenanthrene": 'c1ccc2c(c1)c1ccccc1c1c2C=CC1' "2,2'-(Methylimino)bis(N,N-di-n-octylacetamide)": 'CCCCCCCCN(C(=O)CN(CC(=O)N(CCCCCCCC)CCCCCCCC)C)CCCCCCCC' "2,2'-Bi(1,8-naphthyridine)": 'c1ccc2c(n1)nc(cc2)c1ccc2c(n1)nccc2' "2,2'-Bi-4-lepidine": 'Cc1cc(nc2c1cccc2)c1cc(C)c2c(n1)cccc2' "2,2'-Bicinchoninic Acid Dipotassium Salt Hydrate [for Determination of Cu]": '[O-]C(=O)c1cc(nc2c1cccc2)c1nc2ccccc2c(c1)C(=O)[O-].[K+].[K+].O' "2,2'-Biimidazole": 'c1cnc([nH]1)c1ncc[nH]1' "2,2'-Bipyrazine": 'n1ccnc(c1)c1nccnc1' "2,2'-Bipyridine-3,3'-dicarboxylic Acid": 'OC(=O)c1cccnc1c1ncccc1C(=O)O' "2,2'-Bipyridine-3,3'-diol": 'Oc1cccnc1c1ncccc1O' "2,2'-Bipyridine-4,4'-dicarboxylic Acid": 'OC(=O)c1ccnc(c1)c1nccc(c1)C(=O)O' "2,2'-Bipyridine-5,5'-dicarboxylic Acid": 'OC(=O)c1ccc(nc1)c1ccc(cn1)C(=O)O' "2,2'-Bipyridine-6,6'-dicarboxylic Acid": 'OC(=O)c1cccc(n1)c1cccc(n1)C(=O)O' "2,2'-Bipyridine-6,6'-diol": 'Oc1cccc(n1)c1cccc(n1)O' "2,2'-Bipyridine-6-carbonitrile": 'N#Cc1cccc(n1)c1ccccn1' "2,2'-Bipyridyl": 'c1ccc(nc1)c1ccccn1' "2,2'-Bipyridyl 1,1'-Dioxide": '[O-][n+]1ccccc1c1cccc[n+]1[O-]' "2,2'-Bipyrimidyl": 'c1cnc(nc1)c1ncccn1' "2,2'-Biquinoline": 'c1ccc2c(c1)nc(cc2)c1ccc2c(n1)cccc2' "2,2'-Bis(diphenylphosphino)biphenyl": 'c1ccc(cc1)P(c1ccccc1c1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1' "2,2'-Carbonylbis(3,5-dioxo-4-methyl-1,2,4-oxadiazolidine)": 'O=C(n1oc(=O)n(c1=O)C)n1oc(=O)n(c1=O)C' "2,2'-Diamino-4,4'-bithiazole": 'Nc1scc(n1)c1csc(n1)N' "2,2'-Dipyridyl Disulfide": 'c1ccc(nc1)SSc1ccccn1' "2,2'-Methylenebisbenzothiazole": 'c1ccc2c(c1)sc(n2)Cc1nc2c(s1)cccc2' "2,2'-bpy": 'c1ccc(nc1)c1ccccn1' "2,2,2-Trifluoro-1,1-ethanediol": 'OC(C(F)(F)F)O' "2,2,2-Trifluoro-N,N-dimethylacetamide": 'CN(C(=O)C(F)(F)F)C' "2,2,2-Trifluoroethyl Methanesulfonate": 'FC(COS(=O)(=O)C)(F)F' "2,2,2-Trifluoroethyl Trifluoromethanesulfonate": 'FC(COS(=O)(=O)C(F)(F)F)(F)F' "2,2,2-Trifluoroethyl p-Toluenesulfonate": 'FC(COS(=O)(=O)c1ccc(cc1)C)(F)F' "2,2,3,3,3-Pentafluoropropyl p-Toluenesulfonate": 'FC(C(F)(F)F)(COS(=O)(=O)c1ccc(cc1)C)F' "2,2,6,6-Tetramethylpiperidine": 'CC1(C)CCCC(N1)(C)C' "2,2,6,6-Tetramethylpiperidine 1-Oxyl Free Radical": '[O]N1C(C)(C)CCCC1(C)C' "2,2-Difluoro-2-(fluorosulfonyl)acetic Acid": 'OC(=O)C(S(=O)(=O)F)(F)F' "2,2-Difluoroethyl Trifluoromethanesulfonate": 'FC(COS(=O)(=O)C(F)(F)F)F' "2,2-Difluoroethylamine": 'NCC(F)F' "2,2-Dimethyl-6,6,7,7,8,8,8-heptafluoro-3,5-octanedione": 'O=C(C(C(C(F)(F)F)(F)F)(F)F)CC(=O)C(C)(C)C' "2,3,2-tet": 'NCCNCCCNCCN' "2,3,7,8,12,13,17,18-Octaethylporphyrin": 'CCC1=C(CC)C2=Cc3[nH]c(c(c3CC)CC)C=C3N=C(C=c4[nH]c(=CC1=N2)c(CC)c4CC)C(=C3CC)CC' "2,3,7,8,12,13,17,18-Octafluoro-5,10,15,20-tetrakis(pentafluorophenyl)porphyrin": 'Fc1c(F)c(F)c(c(c1F)C1=C2N=C(C(=C2F)F)C(=c2[nH]c(=C(C3=NC(=C(c4[nH]c1c(F)c4F)c1c(F)c(F)c(c(c1F)F)F)C(=C3F)F)c1c(F)c(F)c(c(c1F)F)F)c(c2F)F)c1c(F)c(F)c(c(c1F)F)F)F' "2,3-Dimethyl-1-propylimidazolium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCC[n+]1ccn(c1C)C' "2,3-Lutidine": 'Cc1ncccc1C' "2,3-NDA": 'OC(=O)c1cc2ccccc2cc1C(=O)O' "2,4'-bpy": 'n1ccc(cc1)c1ccccn1' "2,4,4,6-Tetrabromo-2,5-cyclohexadienone": 'BrC1=CC(Br)(Br)C=C(C1=O)Br' "2,4,5-Trichlorophenol": 'Clc1cc(Cl)c(cc1O)Cl' "2,4,6,8-Tetramethyl-2,4,6,8-tetravinylcyclotetrasiloxane": 'C=C[O]1(C)[SiH2][O](C)(C=C)[SiH2][O]([SiH2][O]([SiH2]1)(C)C=C)(C)C=C' "2,4,6,8-Tetramethylcyclotetrasiloxane": 'C[O]1[SiH2][O](C)[SiH2][O]([SiH2][O]([SiH2]1)C)C' "2,4,6-Tri(2-pyridyl)-1,3,5-triazine": 'c1ccc(nc1)c1nc(nc(n1)c1ccccn1)c1ccccn1' "2,4,6-Tri(4-pyridyl)-1,3,5-triazine (purified by sublimation)": 'n1ccc(cc1)c1nc(nc(n1)c1ccncc1)c1ccncc1' "2,4,6-Trichlorobenzoyl Chloride": 'Clc1cc(Cl)c(c(c1)Cl)C(=O)Cl' "2,4,6-Triisopropylbenzenesulfonyl Chloride": 'CC(c1cc(cc(c1S(=O)(=O)Cl)C(C)C)C(C)C)C' "2,4,6-Trimethylpyridiniump-Toluenesulfonate": 'Cc1cc(C)[nH+]c(c1)C.Cc1ccc(cc1)S(=O)(=O)[O-]' "2,4,6-Tris(3,4,5-trifluorophenyl)boroxin": 'Fc1cc(cc(c1F)F)b1ob(ob(o1)c1cc(F)c(c(c1)F)F)c1cc(F)c(c(c1)F)F' "2,4-Dibromo-6-[(E)-[[(1R,2R)-2-(isoindolin-2-yl)-1,2-diphenylethyl]imino]methyl]phenol": 'Brc1cc(/C=N/[C@@H]([C@H](N2Cc3c(C2)cccc3)c2ccccc2)c2ccccc2)c(c(c1)Br)O' "2,4-Dibromo-6-[[[[(4S,5S)-4,5-dihydro-4,5-diphenyl-1-tosyl-1H-imidazol-2-yl]methyl][(S)-1-phenylethyl]amino]methyl]phenol": 'Cc1ccc(cc1)S(=O)(=O)N1C(=N[C@H]([C@@H]1c1ccccc1)c1ccccc1)CN([C@H](c1ccccc1)C)Cc1cc(Br)cc(c1O)Br' "2,4-Lutidine": 'Cc1ccnc(c1)C' "2,4-Mesitylenedisulfonyl Dichloride": 'Cc1c(c(C)cc(c1S(=O)(=O)Cl)C)S(=O)(=O)Cl' "2,5-Bis(4-bromophenyl)-1,1-dimethyl-3,4-diphenylsilole": 'Brc1ccc(cc1)C1=C(c2ccccc2)C(=C([Si]1(C)C)c1ccc(cc1)Br)c1ccccc1' "2,5-Bis[(trimethylsilyl)ethynyl]thiophene": 'C[Si](C#Cc1ccc(s1)C#C[Si](C)(C)C)(C)C' "2,5-Dibromo-1,1,3,4-tetraphenylsilole": 'BrC1=C(c2ccccc2)C(=C([Si]1(c1ccccc1)c1ccccc1)Br)c1ccccc1' "2,5-Dibromo-1,1-dimethyl-3,4-diphenylsilole": 'BrC1=C(c2ccccc2)C(=C([Si]1(C)C)Br)c1ccccc1' "2,5-Diphenylpyridine": 'c1ccc(cc1)c1ccc(cn1)c1ccccc1' "2,5-Lutidine": 'Cc1ccc(cn1)C' "2,5-Norbornadiene": 'C1=CC2CC1C=C2' "2,5-Norbornadiene (stabilized with BHT)": 'C1=CC2CC1C=C2' "2,6-Bis(2-benzimidazolyl)pyridine": 'c1cc(nc(c1)c1nc2c([nH]1)cccc2)c1nc2c([nH]1)cccc2' "2,6-Bis(2-pyridyl)-4(1H)-pyridone": 'O=c1cc([nH]c(c1)c1ccccn1)c1ccccn1' "2,6-Bis[(2,2,6,6-tetramethyl-1-piperidinyl)methyl]phenylboronic Acid (contains varying amounts of Anhydride)": 'OB(c1c(cccc1CN1C(C)(C)CCCC1(C)C)CN1C(C)(C)CCCC1(C)C)O' "2,6-Bis[(2R,4S,5S)-1-benzyl-4,5-diphenylimidazolidin-2-yl]pyridine": 'c1ccc(cc1)CN1[C@@H](N[C@H]([C@@H]1c1ccccc1)c1ccccc1)c1cccc(n1)[C@@H]1N[C@H]([C@@H](N1Cc1ccccc1)c1ccccc1)c1ccccc1' "2,6-Bis[(2S,4S)-4-methyl-5,5-diphenyloxazolidin-2-yl]pyridine": 'C[C@@H]1N[C@@H](OC1(c1ccccc1)c1ccccc1)c1cccc(n1)[C@H]1N[C@H](C(O1)(c1ccccc1)c1ccccc1)C' "2,6-Bis[(2S,5S)-4,4-diphenyl-1-aza-3-oxabicyclo[3.3.0]octan-2-yl]pyridine": 'c1ccc(cc1)C1(O[C@H](N2[C@H]1CCC2)c1cccc(n1)[C@@H]1OC([C@H]2N1CCC2)(c1ccccc1)c1ccccc1)c1ccccc1' "2,6-Di(1-pyrazolyl)pyridine": 'c1cc(nc(c1)n1cccn1)n1cccn1' "2,6-Di(2H-1,2,3-triazol-4-yl)pyridine": 'c1cc(nc(c1)c1cn[nH]n1)c1cn[nH]n1' "2,6-Dimethyl-3,5-heptanedione": 'CC(C(=O)CC(=O)C(C)C)C' "2,6-Lutidine": 'Cc1cccc(n1)C' "2,6-NDA": 'OC(=O)c1ccc2c(c1)ccc(c2)C(=O)O' "2,8-Difluoro-5-(trifluoromethyl)-5H-dibenzo[b,d]thiophen-5-ium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.Fc1ccc2c(-c3cc(F)ccc3[S+]2C(F)(F)F)c1' "2,9-Dibutyl-1,10-phenanthroline": 'CCCCc1ccc2c(n1)c1nc(CCCC)ccc1cc2' "2,9-Dichloro-1,10-phenanthroline": 'Clc1ccc2c(n1)c1nc(Cl)ccc1cc2' "2,9-Diphenyl-1,10-phenanthroline": 'c1ccc(cc1)c1ccc2c(n1)c1nc(ccc1cc2)c1ccccc1' "2-(1H-1,2,4-Triazol-3-yl)pyridine": 'c1ccc(nc1)c1n[nH]cn1' "2-(2-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine": 'Brc1ccccc1B1Nc2cccc3c2c(N1)ccc3' "2-(2-Hydroxyphenyl)benzothiazole": 'Oc1ccccc1c1nc2c(s1)cccc2' "2-(2-Hydroxyphenyl)benzoxazole": 'Oc1ccccc1c1nc2c(o1)cccc2' "2-(2-Pyridyl)benzoxazole": 'c1ccc(nc1)c1nc2c(o1)cccc2' "2-(2-Pyridyl)indole": 'c1ccc(nc1)c1cc2c([nH]1)cccc2' "2-(3,4-Epoxycyclohexyl)ethyltrimethoxysilane": 'CO[Si](CCC1CCC2C(C1)O2)(OC)OC' "2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine": 'Brc1cccc(c1)B1Nc2cccc3c2c(N1)ccc3' "2-(4-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine": 'Brc1ccc(cc1)B1Nc2cccc3c2c(N1)ccc3' "2-(4-Thiazolyl)benzimidazole": 'c1scc(n1)c1nc2c([nH]1)cccc2' "2-(5-Norbornene-2,3-dicarboximido)-1,1,3,3-tetramethyluronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[O+]N1C(=O)C2C(C1=O)C1CC2C=C1)N(C)C)C' "2-(Di-tert-butylphosphino)biphenyl": 'CC(P(C(C)(C)C)c1ccccc1c1ccccc1)(C)C' "2-(Dicyclohexylphosphino)-2'-(dimethylamino)biphenyl": 'CN(c1ccccc1c1ccccc1P(C1CCCCC1)C1CCCCC1)C' "2-(Dicyclohexylphosphino)biphenyl": 'C1CCC(CC1)P(c1ccccc1c1ccccc1)C1CCCCC1' "2-(Dimethylvinylsilyl)pyridine": 'C=C[Si](c1ccccn1)(C)C' "2-(Diphenylphosphino)benzaldehyde": 'O=Cc1ccccc1P(c1ccccc1)c1ccccc1' "2-(Diphenylphosphino)benzoic Acid": 'OC(=O)c1ccccc1P(c1ccccc1)c1ccccc1' "2-(Diphenylphosphino)benzonitrile": 'N#Cc1ccccc1P(c1ccccc1)c1ccccc1' "2-(Diphenylphosphino)biphenyl": 'c1ccc(cc1)c1ccccc1P(c1ccccc1)c1ccccc1' "2-(Trimethylsilylethynyl)thiophene": 'C[Si](C#Cc1cccs1)(C)C' "2-AG": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)OC(CO)CO' "2-Acetylcyclohexanone": 'O=C1CCCCC1C(=O)C' "2-Acetylcyclopentanone": 'CC(=O)C1CCCC1=O' "2-Bromo-1,10-phenanthroline": 'Brc1ccc2c(n1)c1ncccc1cc2' "2-Bromo-1-ethylpyridinium Tetrafluoroborate": 'F[B-](F)(F)F.CC[n+]1ccccc1Br' "2-Bromo-2-cyano-N,N-dimethylacetamide": 'BrC(C(=O)N(C)C)C#N' "2-Chloro-1,10-phenanthroline": 'Clc1ccc2c(n1)c1ncccc1cc2' "2-Chloro-1,3,2-dioxaphospholane": 'ClP1OCCO1' "2-Chloro-1,3-bis(2,6-diisopropylphenyl)-1H-imidazolium Chloride": 'CC(c1cccc(c1n1cc[n+](c1Cl)c1c(cccc1C(C)C)C(C)C)C(C)C)C.[Cl-]' "2-Chloro-1,3-dimethylimidazolinium Chloride": 'CN1CC[N+](=C1Cl)C.[Cl-]' "2-Chloro-1,3-dimethylimidazolinium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN1CC[N+](=C1Cl)C' "2-Chloro-1,3-dimethylimidazolinium Tetrafluoroborate": 'F[B-](F)(F)F.CN1CC[N+](=C1Cl)C' "2-Chloro-1-methylpyridinium Iodide": 'Clc1cccc[n+]1C.[I-]' "2-Chloro-1-methylpyridiniump-Toluenesulfonate": 'Clc1cccc[n+]1C.Cc1ccc(cc1)S(=O)(=O)[O-]' "2-Chloro-4H-1,3,2-benzodioxaphosphorin-4-one": 'ClP1OC(=O)c2c(O1)cccc2' "2-Cyanoethyltriethoxysilane": 'CCO[Si](OCC)(OCC)CCC#N' "2-Di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl": 'CC(c1cc(cc(c1c1ccccc1P(C(C)(C)C)C(C)(C)C)C(C)C)C(C)C)C' "2-Dicyclohexylphosphino-2',4',6'-triisopropylbiphenyl": 'CC(c1cc(cc(c1c1ccccc1P(C1CCCCC1)C1CCCCC1)C(C)C)C(C)C)C' "2-Dicyclohexylphosphino-2',6'-diisopropoxybiphenyl": 'CC(Oc1cccc(c1c1ccccc1P(C1CCCCC1)C1CCCCC1)OC(C)C)C' "2-Dicyclohexylphosphino-2',6'-dimethoxybiphenyl": 'COc1cccc(c1c1ccccc1P(C1CCCCC1)C1CCCCC1)OC' "2-Fluoro-1-methylpyridiniump-Toluenesulfonate": 'Fc1cccc[n+]1C.Cc1ccc(cc1)S(=O)(=O)[O-]' "2-Furoyltrifluoroacetone": 'O=C(C(F)(F)F)CC(=O)c1ccco1' "2-Hydroxy-2-azaadamantane": 'ON1C2CC3CC1CC(C2)C3' "2-Hydroxybenzaldehyde Phenylhydrazone": 'Oc1ccccc1/C=N/Nc1ccccc1' "2-Hydroxybenzoic Acid": 'OC(=O)c1ccccc1O' "2-HydroxypyridineN-Oxide": 'Oc1cccc[n+]1[O-]' "2-Iodosobenzoic Acid": 'O=[I]c1ccccc1C(=O)O' "2-Iodoxybenzoic Acid": 'O=[I](=O)c1ccccc1C(=O)O' "2-Mepy": 'Cc1ccccn1' "2-Methyl-1,10-phenanthroline": 'Cc1ccc2c(n1)c1ncccc1cc2' "2-Methyl-6-nitrobenzoic Anhydride": 'O=C(c1c(C)cccc1[N+](=O)[O-])OC(=O)c1c(C)cccc1[N+](=O)[O-]' "2-Methylbenzo[e]indene": 'N/A' "2-Methylbenzo[e]indene (mixture of 1H- and 3H-form)": 'N/A' "2-Methylcyclopenta[l]phenanthrene": 'CC1=Cc2c(=C1)c1ccccc1c1=CC=CCc21' "2-Nitrophenylarsonic Acid": '[O-][N+](=O)c1ccccc1[As](=O)(O)O' "2-Norbornene": 'C1CC2CC1C=C2' "2-Phenylethylboronic Acid": 'OB(CCc1ccccc1)O' "2-Salicylideneaminophenol": 'Oc1ccccc1/C=N/c1ccccc1O' "2-Trimethylsilyloxy-1,3-butadiene": 'C=CC(=C)O[Si](C)(C)C' "2-Trimethylsilylthiophene": 'C[Si](c1cccs1)(C)C' "2-[(2,2,6,6-Tetramethyl-1-piperidyl)methyl]phenylboronic Acid (contains varying amounts of Anhydride)": 'OB(c1ccccc1CN1C(C)(C)CCCC1(C)C)O' "2-[N,N-Bis(trifluoromethanesulfonyl)amino]-5-chloropyridine": 'Clc1ccc(nc1)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F' "2C3": 'NCCC(c1cccc(c1)Cl)NC(=O)c1ccc(c(c1)NC(=O)c1cc2cnc(nc2[nH]c1=O)OC)Cl' "2D": 'Brc1ccc2c(c1)SN1C2=NCCC1' "2F": 'C1CN=C2N(C1)Sc1c2ccc(c1)c1ccc2c(c1)OCO2' "2H": 'O' "3,3'-Iminobis(N,N-dimethylpropylamine)": 'CN(CCCNCCCN(C)C)C' "3,3'-Methylenebis(1-tert-butyl-3-imidazolium Bromide)": 'CC(n1cc[n+](c1)C[n+]1ccn(c1)C(C)(C)C)(C)C.[Br-].[Br-]' "3,3'-Methylenebis[1-(2,6-diisopropylphenyl)-3-imidazolium Bromide]": 'CC(c1cccc(c1n1cc[n+](c1)C[n+]1ccn(c1)c1c(cccc1C(C)C)C(C)C)C(C)C)C.[Br-].[Br-]' "3,3,3-tet": 'NCCCNCCCNCCCN' "3,4,7,8-Tetramethyl-1,10-phenanthroline": 'Cc1c(C)cnc2c1ccc1c2ncc(c1C)C' "3,4-Diacetyl-2,5-hexanedione": 'CC(=O)C(C(C(=O)C)C(=O)C)C(=O)C' "3,4-Dihydro-2H-pyrido[1,2-a]pyrimidin-2-one": 'O=C1CCN2C(=N1)C=CC=C2' "3,4-Dihydro-3-hydroxy-4-oxo-1,2,3-benzotriazine": 'On1nnc2c(c1=O)cccc2' "3,4-Lutidine": 'Cc1cnccc1C' "3,5,6,8-Tetrabromo-1,10-phenanthroline": 'Brc1cnc2c(c1)c(Br)c(c1c2ncc(c1)Br)Br' "3,5-Bis(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride)": 'OB(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)O' "3,5-Di(2-pyridyl)pyrazole": 'c1ccc(nc1)c1[nH]nc(c1)c1ccccn1' "3,5-Heptanedione": 'CCC(=O)CC(=O)CC' "3,5-Lutidine": 'Cc1cncc(c1)C' "3,6-Di(2-pyridyl)-1,2,4,5-tetrazine": 'c1ccc(nc1)c1nnc(nn1)c1ccccn1' "3,8-Dibromo-1,10-phenanthroline": 'Brc1cnc2c(c1)ccc1c2ncc(c1)Br' "3-(2-Aminoethylamino)propyltrimethoxysilane": 'NCCNCCC[Si](OC)(OC)OC' "3-(Diethoxyphosphoryloxy)-1,2,3-benzotriazin-4(3H)-one": 'CCOP(=O)(On1nnc2c(c1=O)cccc2)OCC' "3-(Dimethylsilyloxy)-1,1,5,5-tetramethyl-3-phenyltrisiloxane": 'C[SiH](O[Si](c1ccccc1)(O[SiH](C)C)O[SiH](C)C)C' "3-(Diphenylphosphino)-1-propylamine": 'NCCCP(c1ccccc1)c1ccccc1' "3-(Triallylsilyl)propyl Acrylate": 'C=CC[Si](CC=C)(CC=C)CCCOC(=O)C=C' "3-(Triallylsilyl)propyl Methacrylate": 'C=CC[Si](CC=C)(CC=C)CCCOC(=O)C(=C)C' "3-(Triethoxysilyl)propyl Isocyanate": 'CCO[Si](OCC)(OCC)CCCN=C=O' "3-(Trimethoxysilyl)propyl Acrylate": 'C=CC(=O)OCCC[Si](OC)(OC)OC' "3-(Trimethoxysilyl)propyl Methacrylate": 'CO[Si](CCCOC(=O)C(=C)C)(OC)OC' "3-(Trimethylsilylethynyl)thiophene": 'C[Si](C#Cc1cscc1)(C)C' "3-Aminopropyltriethoxysilane": 'NCCC[Si](OCC)(OCC)OCC' "3-Aminopropyltrimethoxysilane": 'NCCC[Si](OC)(OC)OC' "3-Bromo-1,10-phenanthroline": 'Brc1cnc2c(c1)ccc1c2nccc1' "3-Bromo-1-(trimethylsilyl)-1-propyne": 'BrCC#C[Si](C)(C)C' "3-Chloroacetylacetone": 'ClC(C(=O)C)C(=O)C' "3-Chloropropyltriethoxysilane": 'ClCCC[Si](OCC)(OCC)OCC' "3-Ethyl-2,4-pentanedione": 'CCC(C(=O)C)C(=O)C' "3-Glycidyloxypropyltrimethoxysilane": 'CO[Si](CCCOCC1CO1)(OC)OC' "3-Mercaptopropyl(dimethoxy)methylsilane": 'SCCC[Si](OC)(OC)C' "3-Methyl-1-phenyl-2-phospholene 1-Oxide": 'CC1=CP(=O)(CC1)c1ccccc1' "3-Methyl-2,4-pentanedione": 'CC(C(=O)C)C(=O)C' "3-Nitro-1,2,4-triazole": '[O-][N+](=O)c1n[nH]cn1' "3-PCA": 'O=C(c1cccnc1)OC(=O)c1cccnc1' "3-Phenyl-2,4-pentanedione": 'CC(=O)C(c1ccccc1)C(=O)C' "3-Pyridinecarboxylic Anhydride": 'O=C(c1cccnc1)OC(=O)c1cccnc1' "3-Trimethoxysilylpropyl Chloride": 'ClCCC[Si](OC)(OC)OC' "3-Trimethylsilyl-2-propyn-1-ol": 'OCC#C[Si](C)(C)C' "3-[(Dimethylsilyl)oxy]-1,1,3,5,5-pentamethyltrisiloxane": 'C[SiH](O[Si](O[SiH](C)C)(O[SiH](C)C)C)C' "3-[[Dimethyl(vinyl)silyl]oxy]-1,1,5,5-tetramethyl-3-phenyl-1,5-divinyltrisiloxane": 'C=C[Si](O[Si](c1ccccc1)(O[Si](C=C)(C)C)O[Si](C=C)(C)C)(C)C' "3-[[tert-Butyl(dimethyl)silyl]oxy]-1-propanol": 'OCCCO[Si](C(C)(C)C)(C)C' "31P": 'COC(=O)C(C1N=C(c2ccc(cc2)Cl)c2c(N3C1NNC3C)ccc(c2)OC)CC' "3H": 'O' "3O2": 'COCCN1CCC(CC1)(C(=O)NO)S(=O)(=O)c1ccc(cc1)OCCCn1nnc(n1)c1ccc(cc1)OC(F)(F)F' "4'-[(tert-Butyldimethylsilyloxy)methyl]-2,2,2-trifluoroacetophenone": 'O=C(C(F)(F)F)c1ccc(cc1)CO[Si](C(C)(C)C)(C)C' "4,4'-Bis(5-hexyl-2-thienyl)-2,2'-bipyridyl": 'CCCCCCc1ccc(s1)c1ccnc(c1)c1nccc(c1)c1ccc(s1)CCCCCC' "4,4'-Bis(chloromethyl)-2,2'-bipyridyl": 'ClCc1ccnc(c1)c1nccc(c1)CCl' "4,4'-Bis(hydroxymethyl)-2,2'-bipyridine": 'OCc1ccnc(c1)c1nccc(c1)CO' "4,4'-Di-tert-butyl-2,2'-bipyridyl": 'CC(c1ccnc(c1)c1nccc(c1)C(C)(C)C)(C)C' "4,4'-Diamino-2,2'-bipyridyl": 'Nc1ccnc(c1)c1nccc(c1)N' "4,4'-Dibromo-2,2'-bipyridyl": 'Brc1ccnc(c1)c1nccc(c1)Br' "4,4'-Dimethoxy-2,2'-bipyridyl": 'COc1ccnc(c1)c1nccc(c1)OC' "4,4'-Dimethyl-2,2'-bipyridyl": 'Cc1ccnc(c1)c1nccc(c1)C' "4,4'-Dimethyl-2,2'-bipyridyl 1-Oxide": 'Cc1cc[n+](c(c1)c1nccc(c1)C)[O-]' "4,4'-Dinonyl-2,2'-bipyridyl": 'CCCCCCCCCc1ccnc(c1)c1nccc(c1)CCCCCCCCC' "4,4'-bpy": 'n1ccc(cc1)c1ccncc1' "4,4,4-Trifluoro-1-(2-naphthyl)-1,3-butanedione": 'O=C(C(F)(F)F)CC(=O)c1ccc2c(c1)cccc2' "4,4,4-Trifluoro-1-(2-thienyl)-1,3-butanedione": 'O=C(C(F)(F)F)CC(=O)c1cccs1' "4,4,4-Trifluoro-1-(4-methoxyphenyl)-1,3-butanedione": 'COc1ccc(cc1)C(=O)CC(=O)C(F)(F)F' "4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione": 'O=C(c1ccc(cc1)C)CC(=O)C(F)(F)F' "4,4,4-Trifluoro-1-phenyl-1,3-butanedione": 'O=C(c1ccccc1)CC(=O)C(F)(F)F' "4,4,5,5-Tetramethyl-1,3,2-dioxaphospholane 2-Oxide": 'CC1(C)OP(=O)OC1(C)C' "4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene": 'CC1(C)c2cccc(c2Oc2c1cccc2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1' "4,5-Diazafluoren-9-one": 'O=C1c2cccnc2-c2c1cccn2' "4,5-Diazafluorene-9-oneO-(p-Toluenesulfonyl)oxime": 'Cc1ccc(cc1)S(=O)(=O)ON=C1c2cccnc2-c2c1cccn2' "4,6-Bis(diphenylphosphino)phenoxazine": 'c1ccc(cc1)P(c1cccc2c1Oc1c(N2)cccc1P(c1ccccc1)c1ccccc1)c1ccccc1' "4,6-Diphenylthieno[3,4-d]-1,3-dioxol-2-one 5,5-Dioxide": 'O=c1oc2=C(c3ccccc3)S(=O)(=O)C(=c2o1)c1ccccc1' "4,7-Dibromo-1,10-phenanthroline Hydrate": 'Brc1ccnc2c1ccc1c2nccc1Br.O' "4,7-Dichloro-1,10-phenanthroline Hydrate": 'Clc1ccnc2c1ccc1c2nccc1Cl.O' "4,7-Dihydroxy-1,10-phenanthroline": 'Oc1ccnc2c1ccc1c2nccc1O' "4,7-Dimethyl-1,10-phenanthroline": 'Cc1ccnc2c1ccc1c2nccc1C' "4-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-4-methylmorpholinium Chloride": 'COc1nc(nc(n1)OC)[N+]1(C)CCOCC1.[Cl-]' "4-(4-Dimethylaminophenylazo)phenylarsonic Acid Hydrochloride": 'CN(c1ccc(cc1)/N=N/c1ccc(cc1)[As](=O)(O)O)C.Cl' "4-(Bromomethyl)-4'-methyl-2,2'-bipyridyl": 'BrCc1ccnc(c1)c1nccc(c1)C' "4-(Chloromethyl)-4'-methyl-2,2'-bipyridyl": 'ClCc1ccnc(c1)c1nccc(c1)C' "4-(Dimethylamino)phenyldiphenylphosphine": 'CN(c1ccc(cc1)P(c1ccccc1)c1ccccc1)C' "4-(Diphenylphosphino)benzoic Acid": 'OC(=O)c1ccc(cc1)P(c1ccccc1)c1ccccc1' "4-(Trimethylsilyl)-3-butyn-2-one": 'CC(=O)C#C[Si](C)(C)C' "4-(Trimethylsilyl)diphenylacetylene": 'C[Si](c1ccc(cc1)C#Cc1ccccc1)(C)C' "4-Acetamido-2,2,6,6-tetramethyl-1-oxopiperidinium Tetrafluoroborate": 'F[B-](F)(F)F.CC(=O)NC1CC(C)(C)[N+](=O)C(C1)(C)C' "4-Acetamido-2,2,6,6-tetramethylpiperidine 1-Oxyl": '[O]N1C(C)(C)CC(CC1(C)C)NC(=O)C' "4-Acetamido-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical [Catalyst for Oxidation]": '[O]N1C(C)(C)CC(CC1(C)C)NC(=O)C' "4-Anisidin": 'COc1ccc(cc1)N' "4-Bromotetraphenylsilane": 'Brc1ccc(cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "4-Chlorophenyl Phosphorodichloridate": 'Clc1ccc(cc1)OP(=O)(Cl)Cl' "4-Dimethylamino-1-neopentylpyridinium Chloride": 'CN(c1cc[n+](cc1)CC(C)(C)C)C.[Cl-]' "4-Dimethylaminopyridine": 'CN(c1ccncc1)C' "4-Dimethylaminopyridinium Bromide Perbromide": 'CN(c1cc[nH+]cc1)C.Br[Br-]Br' "4-Ethyl-4-methylmorpholinium Bromide": 'CC[N+]1(C)CCOCC1.[Br-]' "4-Fluoro-N-salicylideneaniline": 'Fc1ccc(cc1)/N=C/c1ccccc1O' "4-Fluorophenylmagnesium Bromide": 'Br[Mg]c1ccc(cc1)F' "4-Hydroxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Benzoate": '[O]N1C(C)(C)CC(CC1(C)C)OC(=O)c1ccccc1' "4-Hydroxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Benzoate Free Radical [Catalyst for Oxidation]": '[O]N1C(C)(C)CC(CC1(C)C)OC(=O)c1ccccc1' "4-Hydroxy-3-nitrophenylarsonic Acid": '[O-][N+](=O)c1cc(ccc1O)[As](=O)(O)O' "4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl": 'OCc1ccnc(c1)c1nccc(c1)C' "4-Hydroxyphenylarsonic Acid": 'Oc1ccc(cc1)[As](=O)(O)O' "4-Methoxy-2,2,6,6-tetramethylpiperidine 1-Oxyl": 'COC1CC(C)(C)N(C(C1)(C)C)[O]' "4-Methoxy-2,2,6,6-tetramethylpiperidine 1-Oxyl Free Radical [Catalyst for Oxidation]": 'COC1CC(C)(C)N(C(C1)(C)C)[O]' "4-Methylmorpholine N-Oxide": '[O-][N+]1(C)CCOCC1' "4-Nitrophenol": 'Oc1ccc(cc1)[N+](=O)[O-]' "4-Nitrophenyl Trifluoromethanesulfonate": 'FC(S(=O)(=O)Oc1ccc(cc1)[N+](=O)[O-])(F)F' "4-PPNO": '[O-][n+]1ccc(cc1)c1ccccc1' "4-Pyrrolidinopyridine": 'C1CCN(C1)c1ccncc1' "4-Trifluoromethylbenzoic Anhydride": 'O=C(c1ccc(cc1)C(F)(F)F)OC(=O)c1ccc(cc1)C(F)(F)F' "4-Trimethylsilyl-3-butyn-2-ol": 'CC(C#C[Si](C)(C)C)O' "4-[2,2,2-Trifluoro-1-[(trimethylsilyl)oxy]ethyl]morpholine": 'FC(C(N1CCOCC1)O[Si](C)(C)C)(F)F' "4-[2-[2-(4-Iodophenoxy)ethoxy]carbonyl]benzoyloxy-2,2,6,6-tetramethylpiperidin-1-oxyl": 'Ic1ccc(cc1)OCCOC(=O)c1ccccc1C(=O)OC1CC(C)(C)N(C(C1)(C)C)[O]' "4-tert-Butyl-2,6-dimethylphenylsulfur Trifluoride": 'Cc1cc(cc(c1S(F)(F)F)C)C(C)(C)C' "5,10,15,20-Tetra(4-pyridyl)porphyrin": 'n1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1ccncc1)C=C3)c1ccncc1)[nH]2)c1ccncc1' "5,10,15,20-Tetrakis(2,4,6-trimethylphenyl)porphyrin": 'Cc1cc(C)c(c(c1)C)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1c(C)cc(cc1C)C)C=C3)c1c(C)cc(cc1C)C)[nH]2)c1c(C)cc(cc1C)C' "5,10,15,20-Tetrakis(2,6-dichlorophenyl)porphyrin": 'Clc1cccc(c1C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1c(Cl)cccc1Cl)C=C3)c1c(Cl)cccc1Cl)[nH]2)c1c(Cl)cccc1Cl)Cl' "5,10,15,20-Tetrakis(3,5-dihydroxyphenyl)porphyrin": 'Oc1cc(O)cc(c1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1cc(O)cc(c1)O)C=C3)c1cc(O)cc(c1)O)[nH]2)c1cc(O)cc(c1)O' "5,10,15,20-Tetrakis(3,5-dimethoxyphenyl)porphyrin": 'COc1cc(OC)cc(c1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1cc(OC)cc(c1)OC)C=C3)c1cc(OC)cc(c1)OC)[nH]2)c1cc(OC)cc(c1)OC' "5,10,15,20-Tetrakis(4-carboxymethyloxyphenyl)porphyrin": 'OC(=O)COc1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1ccc(cc1)OCC(=O)O)C=C3)c1ccc(cc1)OCC(=O)O)[nH]2)c1ccc(cc1)OCC(=O)O' "5,10,15,20-Tetrakis(4-hydroxyphenyl)porphyrin": 'Oc1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1ccc(cc1)O)C=C3)c1ccc(cc1)O)[nH]2)c1ccc(cc1)O' "5,10,15,20-Tetrakis(4-methoxyphenyl)porphyrin": 'COc1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1ccc(cc1)OC)C=C3)c1ccc(cc1)OC)[nH]2)c1ccc(cc1)OC' "5,10,15,20-Tetrakis(p-tolyl)porphyrin": 'Cc1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1ccc(cc1)C)C=C3)c1ccc(cc1)C)[nH]2)c1ccc(cc1)C' "5,10,15,20-Tetrakis(pentafluorophenyl)porphyrin": 'Fc1c(F)c(C2=C3C=CC(=N3)C(=c3ccc(=C(C4=NC(=C(c5[nH]c2cc5)c2c(F)c(F)c(c(c2F)F)F)C=C4)c2c(F)c(F)c(c(c2F)F)F)[nH]3)c2c(F)c(F)c(c(c2F)F)F)c(c(c1F)F)F' "5,5'-Bis(trifluoromethyl)-2,2'-bipyridyl": 'FC(c1ccc(nc1)c1ccc(cn1)C(F)(F)F)(F)F' "5,5'-Dibromo-2,2'-bipyridyl": 'Brc1ccc(nc1)c1ccc(cn1)Br' "5,5'-Dimethyl-2,2'-bipyridyl": 'Cc1ccc(nc1)c1ccc(cn1)C' "5,5-Dibromomeldrum's Acid (=5,5-Dibromo-2,2-dimethyl-4,6-dioxy-1,3-dioxane)": 'O=C1OC(C)(C)OC(=O)C1(Br)Br' "5,6-Dimethyl-1,10-phenanthroline": 'Cc1c(C)c2cccnc2c2c1cccn2' "5-(Trimethylsilyl)-1,2,3,4,5-pentamethyl-1,3-cyclopentadiene": 'CC1=C(C)C(C(=C1C)C)(C)[Si](C)(C)C' "5-Bromo-1,10-phenanthroline": 'Brc1cc2cccnc2c2c1cccn2' "5-Chloro-1,10-phenanthroline": 'Clc1cc2cccnc2c2c1cccn2' "5-Methyl-1,10-phenanthroline Hydrate [for Colorimetric Determination of Iron]": 'Cc1cc2cccnc2c2c1cccn2.O' "5-Nitro-1,10-phenanthroline": '[O-][N+](=O)c1cc2cccnc2c2c1cccn2' "5-Sulfosalicylic Acid Dihydrate": 'OC(=O)c1cc(ccc1O)S(=O)(=O)O.O.O' "6,10-Dibenzyl-N,N'-dimethyl-N,N,N',N'-tetrakis(4-methylbenzyl)-1,4-dioxaspiro[4.5]decane-(2R,3R)-diylbis(methylammonium) Bis(tetrafluoroborate)": 'F[B-](F)(F)F.F[B-](F)(F)F.Cc1ccc(cc1)C[N+](C1(CCCC(C21OC[C@@H](O2)[N+](Cc1ccc(cc1)C)(Cc1ccc(cc1)C)(C)C)Cc1ccccc1)Cc1ccccc1)(Cc1ccc(cc1)C)(C)C' "6,10-Dibenzyl-N,N'-dimethyl-N,N,N',N'-tetrakis(4-methylbenzyl)-1,4-dioxaspiro[4.5]decane-(2S,3S)-diylbis(methylammonium) Tetrafluoroborate": 'F[B-](F)(F)F.F[B-](F)(F)F.Cc1ccc(cc1)C[N+](C1(CCCC(C21OC[C@H](O2)[N+](Cc1ccc(cc1)C)(Cc1ccc(cc1)C)(C)C)Cc1ccccc1)Cc1ccccc1)(Cc1ccc(cc1)C)(C)C' "6,6'-Bis(chloromethyl)-2,2'-bipyridyl": 'ClCc1cccc(n1)c1cccc(n1)CCl' "6,6'-Diamino-2,2'-bipyridyl": 'Nc1cccc(n1)c1cccc(n1)N' "6,6'-Dibromo-2,2'-bipyridyl": 'Brc1cccc(n1)c1cccc(n1)Br' "6,6'-Dicyano-2,2'-bipyridyl": 'N#Cc1cccc(n1)c1cccc(n1)C#N' "6,6'-Dimethyl-2,2'-bipyridyl": 'Cc1cccc(n1)c1cccc(n1)C' "6,7-Dihydro-2-(2,4,6-trimethylphenyl)-5H-pyrrolo[2,1-c]-1,2,4-triazolium Perchlorate": '[O-][Cl](=O)(=O)=O.Cc1cc(C)c(c(c1)C)[n+]1cn2c(n1)CCC2' "6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate": 'F[B-](F)(F)F.Fc1c([n+]2cn3c(n2)CCC3)c(F)c(c(c1F)F)F' "6,8-Bis(benzylthio)octanoic Acid": 'OC(=O)CCCCC(SCc1ccccc1)CCSCc1ccccc1' "6-APA": 'OC(=O)[C@@H]1N2C(=O)[C@H]([C@H]2SC1(C)C)N' "6-Bromo-2,2'-bipyridyl": 'Brc1cccc(n1)c1ccccn1' "6-Bromo-4,4'-dimethyl-2,2'-bipyridyl": 'Cc1ccnc(c1)c1cc(C)cc(n1)Br' "6-Methyl-2,4-heptanedione": 'CC(CC(=O)CC(=O)C)C' "6-mercaptopurine": 'S=c1nc[nH]c2c1[nH]cn2' "7-Methyl-1,5,7-triazabicyclo[4.4.0]dec-5-ene": 'CN1CCCN2C1=NCCC2' "8-HQ": 'Oc1cccc2c1nccc2' "9-(2,5-Dimethylphenyl)-10-methylacridinium Perchlorate": '[O-][Cl](=O)(=O)=O.Cc1ccc(c(c1)c1c2ccccc2[n+](c2c1cccc2)C)C' "9-(2,6-Dimethylphenyl)-10-methylacridinium Perchlorate": '[O-][Cl](=O)(=O)=O.Cc1cccc(c1c1c2ccccc2[n+](c2c1cccc2)C)C' "9-(2-Biphenylyl)-10-methylacridinium Perchlorate": '[O-][Cl](=O)(=O)=O.C[n+]1c2ccccc2c(c2c1cccc2)c1ccccc1c1ccccc1' "9-Azajulolidine": 'C1CN2CCCc3c2c(C1)cnc3' "9-BBN": 'C1CC2CCCC(C1)B2' "9-BBN-H": 'C1CC2CCCC(C1)B2' "9-Mesityl-10-methylacridinium Perchlorate": '[O-][Cl](=O)(=O)=O.Cc1cc(C)c(c(c1)C)c1c2ccccc2[n+](c2c1cccc2)C' "9-Mesityl-2,7,10-trimethylacridinium Perchlorate": '[O-][Cl](=O)(=O)=O.Cc1cc(C)c(c(c1)C)c1c2cc(C)ccc2[n+](c2c1cc(C)cc2)C' "9-Methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-2-one": 'O=C1CCN2C(=N1)C(=CC=C2)C' "9H,9H-Triacontafluoro-8,10-heptadecanedione": 'O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F' "A12": 'OC1C(COP(=O)(CP(=O)(O)O)O)OC(C1O)n1cnc2c1ncnc2N' "AA-861": 'OCC#CCCCC#CCCCCC1=C(C)C(=O)C(=C(C1=O)C)C' "AA-GSH": 'O=C(NC(C(=O)NCC(=O)O)CSc1cc(ccc1O)NC(=O)C)CCC(C(=O)O)N' "AAMA": 'NC(=O)CCSCC(C(=O)O)NC(=O)C' "AAO": 'OCC1OC(OC2C(CO)OC(C(C2O)O)O)C(C(C1OC1OC(C)C(C(C1O)O)NC1C=C(CO)C(C(C1O)O)OC1OC(CO)C(C(C1O)O)OC1OC(CO)C(C(C1O)O)O)O)O' "AAPH": 'NC(=N)C(N=NC(C(=N)N)(C)C)(C)C.Cl.Cl' "ABCN": 'N#CC1(CCCCC1)/N=N/C1(CCCCC1)C#N' "ABG": 'OC1C(COP(=O)(OP(=O)(CP(=O)(O)O)O)O)OC(C1O)n1cnc2c1ncnc2N' "ABT": 'OCC(C(CO)N)O' "ACA": 'CCCCCc1ccc(cc1)C=CC(=O)Nc1ccccc1C(=O)O' "ACC": 'OC(=O)C1(N)CC1' "ACE-Cl": 'CC(OC(=O)Cl)Cl' "ACEA": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCCl' "ACN": 'CC#N' "ACRAMTU": '[O-][N+](=O)[O-].CNC(=S)N(CCNc1c2ccccc2[nH+]c2c1cccc2)C' "ACh": 'CC(=O)OCC[N+](C)(C)C' "ACs": 'NCCCCCC(=O)O' "ADA": 'OC(=O)C#CC(=O)O' "ADD": 'O=C(N1CCCCC1)/N=N/C(=O)N1CCCCC1' "ADDP": 'O=C(N1CCCCC1)/N=N/C(=O)N1CCCCC1' "ADMA": 'OC(=O)C(CCCN=C(N(C)C)N)N' "ADP": 'OC1C(COP(=O)(OP(=O)(O)O)O)OC(C1O)n1cnc2c1ncnc2N' "ADTS": 'C=CC[Si](C(c1ccccc1)(c1ccccc1)c1ccccc1)(C)C' "AEA": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCO' "AFB": 'OC1CC2C(C1)C=CCCCC(OC(=O)C=CC2O)C' "AFM1": 'COc1cc2OC3C(c2c2c1c1CCC(=O)c1c(=O)o2)(O)C=CO3' "AG490": 'N#CC(=Cc1ccc(c(c1)O)O)C(=O)NCc1ccccc1' "AHF": 'F' "AHMHA": 'NC(C(C(=O)O)O)CC(C)C' "AHMOA": 'CC(CC(CC(CC(=O)O)O)N)C' "AHP": 'OC(=O)C(CCCc1ccc(cc1)O)N' "AIBN": 'N#CC(/N=N/C(C#N)(C)C)(C)C' "AKBA": 'CC(=O)OC1CCC2(C(C1(C)C(=O)O)CCC1(C2C(=O)C=C2C1(C)CCC1(C2C(C)C(C)CC1)C)C)C' "ALT": 'OCC1OC(O)C(C(C1O)O)O' "AMBN": 'CCC(/N=N/C(C#N)(CC)C)(C#N)C' "AMD": 'OC(=O)C(Cc1ccc(c(c1)O)O)(N)C' "AMP": 'OCC(N)(C)C' "AMPA": 'OC(=O)C(Cc1c(C)o[nH]c1=O)N' "AMPPNP": 'OC1C(COP(=O)(OP(=O)(NP(=O)(O)O)O)O)OC(C1O)n1cnc2c1ncnc2N' "AMPS": 'CC(=O)NC(CS(=O)(=O)O)(C)C' "AMX": 'O=C(NCCCC(=O)N)CCNC(=O)C(C(COP(=O)(OP(=O)(OCC1OC(C(C1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O' "ANIT": 'S=C=Nc1cccc2c1cccc2' "AOAA": 'NOCC(=O)O' "AOH": 'Oc1cc(C)c2c(c1)oc(=O)c1c2cc(O)cc1O' "AOT": 'CCCCC(COC(=O)CC(S(=O)(=O)[O-])C(=O)OCC(CCCC)CC)CC.[Na+]' "AP5": 'OC1C(COP(=O)(OP(=O)(OP(=O)(OP(=O)(OP(=O)(OCC2OC(C(C2O)O)n2cnc3c2ncnc3N)O)O)O)O)O)OC(C1O)n1cnc2c1ncnc2N' "APAP": 'CC(=O)Nc1ccc(cc1)O' "APO": 'O=P(N1CC1)(N1CC1)N1CC1' "ARA": 'OC1COC(C(C1O)O)O' "ARG": 'OC(=O)C(CCCN=C(N)N)N' "ARS": '[As]' "ASA": 'CC(=O)Oc1ccccc1C(=O)O' "ATP": 'OC1C(COP(=O)(OP(=O)(OP(=O)(O)O)O)O)OC(C1O)n1cnc2c1ncnc2N' "ATPB": 'CC(=O)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]' "ATPH": '[O-]c1c(cccc1c1ccccc1)c1ccccc1.[O-]c1c(cccc1c1ccccc1)c1ccccc1.[O-]c1c(cccc1c1ccccc1)c1ccccc1.[Al+3]' "ATRA": 'CC(=CC=CC(=CC(=O)O)C)C=CC1=C(C)CCCC1(C)C' "ATX": 'CC(C(=O)c1nnc(o1)C(C)(C)C)N' "ATZ": 'COC(=O)NC(C(C)(C)C)C(=O)NN(Cc1ccc(cc1)c1ccccn1)CC(C(Cc1ccccc1)NC(=O)C(C(C)(C)C)NC(=O)OC)O' "AUR": 'CCC1OC2(C(C1(C)OC(C2O)C=CC=CC=Cc1oc(=O)cc(c1C)OC)OC(=O)C)C' "AVB": 'O=C(C1CCCNC1)Nc1ccc(cn1)Br' "AVE": 'O=C(NC(=O)c1cc(F)c(cc1Cl)F)Nc1ccc(cc1OC(F)(F)F)C(=O)O' "AVM": 'CC(=O)Nc1cccc(c1)c1cc(cc(c1)c1ccc2c(c1)nccc2)C(=O)O' "AZT": 'OCC1OC(CC1N=[N+]=[N-])n1cc(C)c(=O)[nH]c1=O' "AZT-TP": '[N-]=[N+]=NC1CC(OC1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1cc(C)c(=O)[nH]c1=O' "Aaptamine": 'COc1cc2C=CNc3c2c(c1OC)ncc3' "Abacavir": 'OCC1C=CC(C1)n1cnc2c1nc(N)nc2NC1CC1' "Abietane": 'CC(C1CCC2C(C1)CCC1C2(C)CCCC1(C)C)C' "Ac-Phe-Phe-NH2": 'CC(=O)NC(C(=O)NC(C(=O)N)Cc1ccccc1)Cc1ccccc1' "Ac2O": 'CC(=O)OC(=O)C' "AcK": 'OCC1OC(C2C1OP(=O)(O2)O)n1cnc2c1ncnc2N' "AcOEt": 'CCOC(=O)C' "AcOH": 'CC(=O)O' "AcOK": '[O-]C(=O)C.[K+]' "AcOt-Bu": 'CC(=O)OC(C)(C)C' "AcV": '[O-]C(=O)CC=C' "Acac": 'CC(=O)CC(=O)C' "Acamprosate": 'CC(=O)NCCCS(=O)(=O)O' "Acenaphthylene": 'c1cc2cccc3c2c(c1)C=C3' "Acetaminophen": 'CC(=O)Nc1ccc(cc1)O' "Acetazolamide": 'CC(=O)Nc1nnc(s1)S(=O)(=O)N' "Acetic Acid": 'CC(=O)O' "Acetic Acid (1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Ester": 'CC(=O)O[C@@H]([C@@H](N(S(=O)(=O)c1c(C)cc(cc1C)C)Cc1ccccc1)C)c1ccccc1' "Acetic Acid (1S,2R)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Ester": 'CC(=O)O[C@H]([C@H](N(S(=O)(=O)c1c(C)cc(cc1C)C)Cc1ccccc1)C)c1ccccc1' "Acetylacetone": 'CC(=O)CC(=O)C' "Ach": 'CC(=O)OCC[N+](C)(C)C' "Achyrofuran": 'CCC(C(=O)c1c(O)c(CC(C(=C)C)O)c2c(c1O)c1c(O)c(CC=C(C)C)c(c(c1o2)C(=O)C(CC)C)O)C' "Acitretin": 'COc1cc(C)c(c(c1C)C)C=CC(=CC=CC(=CC(=O)O)C)C' "Acridine": 'c1ccc2c(c1)nc1c(c2)cccc1' "Acrolein": 'C=CC=O' "Acrylamide": 'NC(=O)C=C' "Actinorhodin": 'OC(=O)CC1OC(C)c2c(C1)c(O)c1c(c2O)C(=O)C(=CC1=O)C1=CC(=O)c2c(C1=O)c(O)c1c(c2O)CC(OC1C)CC(=O)O' "Acyclovir": 'Nc1nc(=O)c2c([nH]1)n(COCCO)cn2' "AdOx": 'O=CC(n1cnc2c1ncnc2N)OC(C=O)CO' "Adderall": 'CC(Cc1ccccc1)N' "Ade": 'Nc1ncnc2c1[nH]cn2' "Adenine": 'Nc1ncnc2c1[nH]cn2' "Adenosine": 'OCC1OC(C(C1O)O)n1cnc2c1ncnc2N' "Adriamycin": 'OCC(=O)C1(O)CC(OC2CC(N)C(C(O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC' "Aerosil": 'O=[Si]=O' "Afinitor": 'OCCOC1CCC(CC1OC)CC(C1OC(=O)C2CCCCN2C(=O)C(=O)C2(O)OC(CCC2C)CC(OC)C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)C1)C)C)O)OC)C)C)C)C' "Ag": '[Ag]' "AgCl": 'Cl[Ag]' "AgNO3": '[O-][N+](=O)[O-].[Ag+]' "Agmatine": 'NCCCCN=C(N)N' "Agomelatine": 'COc1ccc2c(c1)c(CCNC(=O)C)ccc2' "Al": '[Al]' "Al(OH)3": '[Al+3].[OH-].[OH-].[OH-]' "Al2O3": '[O-2].[O-2].[O-2].[Al+3].[Al+3]' "AlBr3": '[Al+3].[Br-].[Br-].[Br-]' "AlCl3": 'Cl[Al](Cl)Cl' "AlI3": '[Al+3].[I-].[I-].[I-]' "Ala": 'C[C@@H](C(=O)O)N' "Alachlor": 'COCN(c1c(CC)cccc1CC)C(=O)CCl' "Albendazole": 'CCCSc1ccc2c(c1)[nH]c(n2)NC(=O)OC' "Aldose": 'OC(C=O)CO' "Aldosterone": 'OCC(=O)C1CCC2C1(C=O)CC(O)C1C2CCC2=CC(=O)CCC12C' "Alendronate": 'NCCCC(P(=O)(O)O)(P(=O)(O)O)O' "AlkylFluor": 'F[B-](F)(F)F.CC(c1cccc(c1n1cc[n+](c1F)c1c(cccc1C(C)C)C(C)C)C(C)C)C' "Allicin": 'C=CCSS(=O)CC=C' "Allopurinol": 'O=c1ncnc2-c1c[nH][nH]2' "Alloxan": 'O=C1NC(=O)C(=O)C(=O)N1' "Allyl(chloromethyl)dimethylsilane": 'ClC[Si](CC=C)(C)C' "Allyl(tert-butyl)dimethylsilane": 'C=CC[Si](C(C)(C)C)(C)C' "Allylchlorodimethylsilane": 'C=CC[Si](Cl)(C)C' "Allylmagnesium Bromide": 'Br[Mg]CC=C' "Allylmagnesium Chloride": 'Cl[Mg]CC=C' "Allyloxytrimethylsilane": 'C=CCO[Si](C)(C)C' "Allylpalladium(II) Chloride": 'C=CC[Pd+].[Cl-]' "Allyltriethoxysilane": 'CCO[Si](CC=C)(OCC)OCC' "Allyltriethylsilane": 'CC[Si](CC=C)(CC)CC' "Allyltriisopropylsilane": 'C=CC[Si](C(C)C)(C(C)C)C(C)C' "Allyltrimethoxysilane": 'CO[Si](CC=C)(OC)OC' "Allyltrimethylsilane": 'C=CC[Si](C)(C)C' "Allyltriphenyltin": 'C=CC[Sn](c1ccccc1)(c1ccccc1)c1ccccc1' "Allyltris(trimethylsilyloxy)silane": 'C=CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C' "Almorexant": 'CNC(=O)C(N1CCc2c(C1CCc1ccc(cc1)C(F)(F)F)cc(c(c2)OC)OC)c1ccccc1' "Alpha-asarone": 'CC=Cc1cc(OC)c(cc1OC)OC' "Alternariol": 'Oc1cc(C)c2c(c1)oc(=O)c1c2cc(O)cc1O' "Alumina": 'O=[Al]O[Al]=O' "Aluminum Bromide Anhydrous": '[Al+3].[Br-].[Br-].[Br-]' "Aluminum Glycinate": '[O-]C(=O)CN.[O-]C(=O)CN.[O-]C(=O)CN.[Al+3]' "Aluminum Isopropoxide": '[O-]C(C)C.[O-]C(C)C.[O-]C(C)C.[Al+3]' "Aluminum(III) Bromide": '[Al+3].[Br-].[Br-].[Br-]' "Aluminum(III) Chloride": '[Al+3].[Cl-].[Cl-].[Cl-]' "Amben": 'NCc1ccc(cc1)C(=O)O' "Amikacin": 'NCCC(C(=O)NC1CC(N)C(C(C1OC1OC(CO)C(C(C1O)N)O)O)OC1OC(CN)C(C(C1O)O)O)O' "Aminomethanesulfonic Acid": 'NCS(=O)(=O)O' "Amiodarone": 'CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2' "Amisulpride": 'CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC' "Amitriptyline": 'CN(CCC=C1c2ccccc2CCc2c1cccc2)C' "Ammonium Cerium(IV) Nitrate": '[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[Ce+4].[NH4+]' "Amoxicillin": 'O=C(C(c1ccc(cc1)O)N)NC1C(=O)N2C1SC(C2C(=O)O)(C)C' "Amphetamine": 'CC(Cc1ccccc1)N' "Ampicillin": 'NC(c1ccccc1)C(=O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C' "Amprenavir": 'CC(CN(S(=O)(=O)c1ccc(cc1)N)CC(C(Cc1ccccc1)NC(=O)OC1CCOC1)O)C' "Amyltriethylammonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCC[N+](CCC)(CCC)CCC' "Anagliptin": 'N#CC1CCCN1C(=O)CNC(CNC(=O)c1cnc2n(c1)nc(c2)C)(C)C' "Anandamide": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCO' "Andalusol": 'C=CC(=C)CCC1C(C)(O)CC(C2C1(C)CCCC2(C)CO)O' "Anisidine": 'COc1ccc(cc1)N' "Anisole": 'COc1ccccc1' "Anl": 'Nc1ccccc1' "Annatto": 'CC(=CC=CC=C(C=CC=C(C=CC(=O)O)C)C)C=CC=C(C=CC(=O)O)C' "Anthracycline": 'COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)C(OC1CC(N)C(C(O1)C)O)CC(C2)(O)C(=O)C' "Antipyrine": 'O=c1cc(n(n1c1ccccc1)C)C' "Antofine": 'COc1ccc2c(c1)c1cc(OC)c(cc1c1c2CN2CCCC2C1)OC' "Apigenin": 'Oc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2O)O' "Apixaban": 'COc1ccc(cc1)n1nc(c2c1C(=O)N(CC2)c1ccc(cc1)N1CCCCC1=O)C(=O)N' "Apocynin": 'COc1cc(ccc1O)C(=O)C' "Apomorphine": 'CN1CCc2c3C1Cc1ccc(c(c1-c3ccc2)O)O' "Aprepitant": 'Fc1ccc(cc1)C1C(OCCN1Cc1[nH][nH]c(=O)n1)OC(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C' "Ar": '[Ar]' "Ara": 'OC1COC(C(C1O)O)O' "Ara-C": 'OCC1OC(C(C1O)O)n1ccc(nc1=O)N' "Ara-U": 'OCC1OC(C(C1O)O)n1ccc(=O)[nH]c1=O' "Arachidonate": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)O' "Arg": 'NC(=N)NCCC[C@@H](C(=O)O)N' "Arg-Arg": 'NC(=NCCCC(C(=O)NC(C(=O)O)CCCN=C(N)N)N)N' "Arg-Gly-Asp": 'O=C(NC(C(=O)O)CC(=O)O)CNC(=O)C(CCCN=C(N)N)N' "Aripiprazole": 'O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl' "Arvelexin": 'N#CCc1c[nH]c2c1c(OC)ccc2' "As2O3": 'O1[As]2O[As]3O[As]1O[As](O2)O3' "As2S2": 'S=[As][As]=S' "AsA": 'CC(=O)Oc1ccccc1C(=O)O' "Ascorbigen": 'OC1COC2(C1OC(=O)C2(O)Cc1c[nH]c2c1cccc2)O' "Asn": 'NC(=O)C[C@@H](C(=O)O)N' "Asp": 'NC(=O)C[C@@H](C(=O)O)N' "Aspirin": 'CC(=O)Oc1ccccc1C(=O)O' "Astaxanthin": 'CC(=CC=CC=C(C=CC=C(C=CC1=C(C)C(=O)C(CC1(C)C)O)C)C)C=CC=C(C=CC1=C(C)C(=O)C(CC1(C)C)O)C' "Ataluren": 'Fc1ccccc1c1onc(n1)c1cccc(c1)C(=O)O' "Atomoxetine": 'CNCCC(c1ccccc1)Oc1ccccc1C' "Atorvastatin": 'OC(CC(CC(=O)O)O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1' "Atrazine": 'CCNc1nc(NC(C)C)nc(n1)Cl' "Au": '[Au]' "Au(OH)3": '[Au+3].[OH-].[OH-].[OH-]' "AuF": 'CC[PH+](CC)CC.[Au]' "Auraptene": 'CC(=CCOc1ccc2c(c1)oc(=O)cc2)CCC=C(C)C' "Avibactam": 'NC(=O)C1CCC2CN1C(=O)N2OS(=O)(=O)O' "Avobenzone": 'COc1ccc(cc1)C(=O)CC(=O)c1ccc(cc1)C(C)(C)C' "Axitinib": 'CNC(=O)c1ccccc1Sc1ccc2c(c1)[nH]nc2C=Cc1ccccn1' "Azilsartan": 'CCOc1nc2c(n1Cc1ccc(cc1)c1ccccc1c1[nH]oc(=O)n1)c(ccc2)C(=O)O' "Azone": 'CCCCCCCCCCCCN1CCCCCC1=O' "Azophloxine": 'CC(=O)Nc1cc(cc2c1C(=O)C(=NNc1ccccc1)C(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]' "B(OH)3": 'OB(O)O' "BAAS": 'CC(=O)Nc1ccc(cc1)/C=C/c1ccc(cc1)NC(=O)C' "BAC": 'NC1C(C)OC(C(C1O)N)O' "BADA": 'BrCC(OCC)OCC' "BADGE": 'CC(c1ccc(cc1)OCC1OC1)(c1ccc(cc1)OCC1OC1)C' "BAIB": 'CC(=O)Oc1c(cccc1I)OC(=O)C' "BAPTA": 'OC(=O)CN(c1ccccc1OCCOc1ccccc1N(CC(=O)O)CC(=O)O)CC(=O)O' "BAPTA-AM": 'O=C(CN(c1ccccc1OCCOc1ccccc1N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)OCOC(=O)C' "BARF": 'FC(c1cc(cc(c1)C(F)(F)F)[B-](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(F)F' "BBC": 'BrN(C(=O)OC(C)(C)C)Br' "BBD": '[O-][N+](=O)c1ccc(c2c1non2)NCc1ccccc1' "BBEDA": 'N/C(=C\c1ccccc1)/C(=C/c1ccccc1)/N' "BBH": 'ClC1C(Cl)C(Cl)C(C(C1Cl)Cl)Cl' "BBP": 'CCCCOC(=O)c1ccccc1C(=O)OCc1ccccc1' "BBS": 'CC(c1ccc(cc1)S(=O)(=O)O)(C)C' "BBr3": 'BrB(Br)Br' "BCNU": 'ClCCNC(=O)N(CCCl)N=O' "BCl3": 'ClB(Cl)Cl' "BDCB": 'Brc1[nH]c2c(n1)cc(c(c2)Cl)Cl' "BDE-47": 'Brc1ccc(c(c1)Br)Oc1ccc(cc1Br)Br' "BDE-49": 'Brc1ccc(c(c1)Br)Oc1cc(Br)ccc1Br' "BDE-99": 'Brc1ccc(c(c1)Br)Oc1cc(Br)c(cc1Br)Br' "BDE209": 'Brc1c(Oc2c(Br)c(Br)c(c(c2Br)Br)Br)c(Br)c(c(c1Br)Br)Br' "BDMAP": 'CN(c1ccc2c3c1ccc1c3c(cc2)c(cc1)N(C)C)C' "BDO": 'OCCCCO' "BDPC": 'O=C(Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]' "BDS": 'S(Cc1ccccc1)SCc1ccccc1' "BDZ": 'OCC1OC(O)C(C(C1OC1OC(CO)C(C(C1OC1OC(C)C(C(C1O)O)O)O)O)OC1OC(C)C(C(C1O)O)O)NC(=O)C' "BEA": 'Cc1cccc2c1n1cnnc1s2' "BEP": 'CCCCC(CO)(CO)CC' "BF3": 'FB(F)F' "BF3-methanol": 'FB(F)F.CO' "BF3.MeOH": 'FB(F)F.CO' "BF4Li": 'F[B-](F)(F)F.[Li+]' "BFO": '[O-][n+]1onc2c1cccc2' "BGG": 'O=COC(c1ccccc1)[O-]' "BH3": 'B' "BH3-DMS": 'CSC.B' "BH3.DMS": 'CSC.B' "BH3.Me2S": 'CSC.B' "BHA": 'COc1ccc(cc1C(C)(C)C)O.COc1ccc(c(c1)C(C)(C)C)O' "BHC": 'ClC1C(Cl)C(Cl)C(C(C1Cl)Cl)Cl' "BHQ": 'CC(c1cc(O)c(cc1O)C(C)(C)C)(C)C' "BHT": 'Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C' "BIBC": 'c1ccc2c(c1)[nH+]c[nH]2.[O-][Cr](=O)(=O)Br' "BIC": 'CCCCN=C=O' "BIDC": 'c1ccc2c(c1)[nH+]c[nH]2.c1ccc2c(c1)[nH+]c[nH]2.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]' "BINALH": 'Oc1ccc2c(c1c1c(O)ccc3c1cccc3)cccc2.CCO[Al+2].[H-].[H-].[H-].[Li+]' "BINAP": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1' "BLM": 'OCC1OC(OC(C(C(=O)NC(C(C(C(=O)NC(C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCC[S+](C)C)C(O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)C(CC(=O)N)NCC(C(=O)N)N)c2[nH]cnc2)C(C(C1O)O)OC1OC(CO)C(C(C1O)OC(=O)N)O' "BMBO": 'BrCc1occ(n1)C(=O)OC(C)(C)C' "BMS": 'CSC.B' "BN": 'B#N' "BNAH": 'NC(=O)C1=CN(C=CC1)Cc1ccccc1' "BNBTS": 'BrN(S(=O)(=O)c1ccc(cc1)C)CCN(S(=O)(=O)c1ccc(cc1)C)Br' "BNP": '[O-]P1(=O)Oc2ccc3c(c2-c2c(O1)ccc1c2cccc1)cccc3' "BNZ": 'c1ccccc1' "BODIPY": 'F[B-]1(F)n2cccc2C=C2[N+]1=CC=C2' "BOP": 'F[P-](F)(F)(F)(F)F.CN([P+](=O)(c1cccc2c1[nH]nn2)(N(C)C)N(C)C)C' "BOP-Cl": 'O=C1OCCN1P(=O)(N1CCOC1=O)Cl' "BOPDC": 'O=C1OCCN1P(=O)(N1CCOC1=O)Cl' "BPA": 'CC(c1ccc(cc1)O)(c1ccc(cc1)O)C' "BPAF": 'FCC(c1c(F)c(F)c(c(c1F)F)OF)(c1ccc(cc1)O)C' "BPCC": 'c1cc[nH+]c(c1)c1cccc[nH+]1.[O-][Cr](=O)(=O)Cl.[O-][Cr](=O)(=O)Cl' "BPDE": 'OC1C2OC2c2c(C1O)cc1c3c2ccc2c3c(cc1)ccc2' "BPO": 'O=C(c1ccccc1)OOC(=O)c1ccccc1' "BPZ": 'Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccc1' "BQC": '[O-]C(=O)c1cc(nc2c1cccc2)c1nc2ccccc2c(c1)C(=O)[O-].[K+].[K+]' "BQCA": 'COc1ccc(cc1)Cn1cc(C(=O)O)c(=O)c2c1cccc2' "BSA": 'CC(=[O][Si](C)(C)C)N[Si](C)(C)C' "BSB": 'O=C(c1ccccc1[Si](C)(C)C)N[Si](C)(C)C' "BSC": 'O=C(O[Si](C)(C)C)N[Si](C)(C)C' "BSM": 'O=S(c1ccccc1)N1CCOCC1' "BSMBO": 'O=C(c1coc(n1)CS(=O)(=O)c1ccccc1)OC(C)(C)C' "BSTFA": 'C[Si](NC(=[O][Si](C)(C)C)C(F)(F)F)(C)C' "BTA": 'C[N+](Cc1ccccc1)(C)C.[F-]' "BTBPE": 'Brc1cc(Br)cc(c1OCCOc1c(Br)cc(cc1Br)Br)Br' "BTC": 'O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl' "BTEAB": 'CC[N+](Cc1ccccc1)(CC)CC.[Br-]' "BTEAC": 'CC[N+](Cc1ccccc1)(CC)CC.[Cl-]' "BTF": 'FC(c1ccccc1)(F)F' "BTH": 'CSC(=O)c1cccc2c1snn2' "BTI": 'Ic1cccc(c1OC(=O)C(F)(F)F)OC(=O)C(F)(F)F' "BTIB": 'Ic1cccc(c1OC(=O)C(F)(F)F)OC(=O)C(F)(F)F' "BTSC": 'C[Si](O[Cr](=O)(=O)O[Si](C)(C)C)(C)C' "BTSP": 'C[Si](OO[Si](C)(C)C)(C)C' "BTX-B": 'O=CC(=C)CC1CC(O)C2(C(O1)CC1C(O2)CC2C(O1)C=CCC1(C(O2)CC2(C)OC3(C)CCC4C(OC3CC2O1)C(C)CC1C(O4)CC2(C)OC3C(=CC(=O)OC3CC2O1)C)C)C' "BUP": 'OC1C(COP(=O)(OP(=O)(OP(=O)(O)O)O)O)OC(C1O)n1cc(Br)c(=O)[nH]c1=O' "BVDU": 'BrC=Cc1cn(C2CC(C(O2)CO)O)c(=O)[nH]c1=O' "BZD": 'OCC1OC(NC(=O)NC(=O)c2ccccc2)C(C(C1O)O)O' "Ba(OH)2": '[Ba+2].[OH-].[OH-]' "BaCl2": '[Cl-].[Cl-].[Ba+2]' "BaSO4": '[O-]S(=O)(=O)[O-].[Ba+2]' "Baclofen": 'NCC(c1ccc(cc1)Cl)CC(=O)O' "Baicalein": 'Oc1cc2oc(cc(=O)c2c(c1O)O)c1ccccc1' "Baicalin": 'OC(=O)C1OC(Oc2cc3oc(cc(=O)c3c(c2O)O)c2ccccc2)C(C(C1O)O)O' "Bathophenanthroline": 'c1ccc(cc1)c1ccnc2c1ccc1c2nccc1c1ccccc1' "Bathophenanthroline (purified by sublimation)": 'c1ccc(cc1)c1ccnc2c1ccc1c2nccc1c1ccccc1' "Bathophenanthrolinedisulfonic Acid Disodium Salt Hydrate [for Determination of Ferrous Ion]": '[O-]S(=O)(=O)c1nc2c3nccc(c3ccc2c(c1S(=O)(=O)[O-])c1ccccc1)c1ccccc1.[Na+].[Na+].O' "Be(OH)3": '[Be+2].[OH-].[OH-]' "BePI": 'NCCCNc1ncc(c2c1c1c([nH]2)ccc2c1ccc(c2)OC)C' "Benzeneruthenium(II) Chloride": 'c1ccccc1.[Cl-].[Cl-].[Ru+2]' "Benzenesulfonic Acid Anhydrous": 'OS(=O)(=O)c1ccccc1' "Benzenesulfonic Acid Monohydrate": 'OS(=O)(=O)c1ccccc1.O' "Benzoic Acid": 'OC(=O)c1ccccc1' "Benzoyl(phenyliodonio)(trifluoromethanesulfonyl)methanide": 'O=C([C-](S(=O)(=O)C(F)(F)F)[I+]c1ccccc1)c1ccccc1' "Benzylcetyldimethylammonium Chloride Hydrate": 'CCCCCCCCCCCCCCCC[N+](Cc1ccccc1)(C)C.[Cl-].O' "Benzyldimethyltetradecylammonium Chloride Hydrate": 'CCCCCCCCCCCCCC[N+](Cc1ccccc1)(C)C.[Cl-].O' "Benzyldodecyldimethylammonium Bromide": 'CCCCCCCCCCCC[N+](Cc1ccccc1)(C)C.[Br-]' "Benzyldodecyldimethylammonium Chloride Dihydrate": 'CCCCCCCCCCCC[N+](Cc1ccccc1)(C)C.[Cl-].O.O' "Benzylmagnesium Bromide": 'Br[Mg]Cc1ccccc1' "Benzylmagnesium Chloride": 'Cl[Mg]Cc1ccccc1' "Benzyltributylammonium Bromide": 'CCCC[N+](Cc1ccccc1)(CCCC)CCCC.[Br-]' "Benzyltributylammonium Chloride": 'CCCC[N+](Cc1ccccc1)(CCCC)CCCC.[Cl-]' "Benzyltriethylammonium Borohydride": 'CC[N+](Cc1ccccc1)(CC)CC.[BH4-]' "Benzyltriethylammonium Bromide": 'CC[N+](Cc1ccccc1)(CC)CC.[Br-]' "Benzyltriethylammonium Chloride": 'CC[N+](Cc1ccccc1)(CC)CC.[Cl-]' "Benzyltriethylammonium Iodide": 'CC[N+](Cc1ccccc1)(CC)CC.[I-]' "Benzyltrimethylammonium Bromide": 'C[N+](Cc1ccccc1)(C)C.[Br-]' "Benzyltrimethylammonium Chloride": 'C[N+](Cc1ccccc1)(C)C.[Cl-]' "Benzyltrimethylammonium Dichloroiodate": 'C[N+](Cc1ccccc1)(C)C.Cl[I-]Cl' "Benzyltrimethylammonium Hydroxide": 'C[N+](Cc1ccccc1)(C)C.[OH-]' "Benzyltrimethylammonium Tetrachloroiodate": 'C[N+](Cc1ccccc1)(C)C.Cl[I-](Cl)(Cl)Cl' "Benzyltrimethylammonium Tribromide": 'C[N+](Cc1ccccc1)(C)C.[Br-].[Br-].[Br-]' "Benzyltrimethylsilane": 'C[Si](Cc1ccccc1)(C)C' "Berberine": 'COc1c(OC)ccc2c1c[n+]1CCc3c(-c1c2)cc1c(c3)OCO1' "Beta-glucogallin": 'OCC1OC(OC(=O)c2cc(O)c(c(c2)O)O)C(C(C1O)O)O' "Bexarotene": 'Cc1cc2c(cc1C(=C)c1ccc(cc1)C(=O)O)C(C)(C)CCC2(C)C' "Bezafibrate": 'Clc1ccc(cc1)C(=O)NCCc1ccc(cc1)OC(C(=O)O)(C)C' "Bicalutamide": 'N#Cc1ccc(cc1C(F)(F)F)NC(=O)C(CS(=O)(=O)c1ccc(cc1)F)(O)C' "Bicinchoninic Acid Disodium Salt Hydrate": '[O-]C(=O)c1c(cnc2c1cccc2)c1cnc2c(c1C(=O)[O-])cccc2.[Na+].[Na+].O' "Biguanide": 'NC(=NC(=N)N)N' "Bilirubin": 'C=CC1=C(C)C(=Cc2[nH]c(c(c2C)CCC(=O)O)Cc2[nH]c(c(c2CCC(=O)O)C)C=C2NC(=O)C(=C2C=C)C)NC1=O' "Biotin": 'OC(=O)CCCCC1SCC2C1NC(=O)N2' "Biphalin": 'CC(C(=O)NCC(=O)NC(C(=O)NNC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C(NC(=O)C(Cc1ccc(cc1)O)N)C)Cc1ccccc1)NC(=O)C(Cc1ccc(cc1)O)N' "Bis(1,3-propanediamine) Copper(II) Dichloride": 'NCCCN.NCCCN.[Cl-].[Cl-].[Cu+2]' "Bis(1,5-cyclooctadiene)nickel(0)": 'C1CC=CCCC=C1.C1CC=CCCC=C1.[Ni]' "Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate": 'C1CC=CCCC=C1.C1CC=CCCC=C1.F[B-](F)(F)F.[Rh+]' "Bis(2,4,6-trimethylpyridine)bromonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.Cc1cc(C)nc(c1)C.Cc1cc(C)c(c(n1)C)[BrH+]' "Bis(2,4,6-trimethylpyridine)iodonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.Cc1cc(C)nc(c1)C.Cc1cc(C)c(c(n1)C)[IH+]' "Bis(2,4-pentanedionato)bis(2-propanolato)titanium(IV)": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[O-]C(C)C.[O-]C(C)C.[Ti+4]' "Bis(2,4-pentanedionato)cobalt(II)": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Co+2].O' "Bis(2,4-pentanedionato)cobalt(II) Dihydrate": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Co+2].O.O' "Bis(2,4-pentanedionato)manganese(II) Dihydrate": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Mn+2].O.O' "Bis(2,4-pentanedionato)molybdenum(VI) Dioxide": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[O-2].[O-2].[Mo+6]' "Bis(2,4-pentanedionato)nickel(II) Hydrate": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Ni+2].O' "Bis(2,4-pentanedionato)vanadium(IV) Oxide": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[O-2].[V+4]' "Bis(2-hydroxyethyl)dimethylammonium Chloride": 'OCC[N+](CCO)(C)C.[Cl-]' "Bis(4-methoxyphenyl) Selenoxide": 'COc1ccc(cc1)[Se](=O)c1ccc(cc1)OC' "Bis(4-nitrophenyl) Carbonate": 'O=C(Oc1ccc(cc1)[N+](=O)[O-])Oc1ccc(cc1)[N+](=O)[O-]' "Bis(acetato)aqua[(S,S)-4,6-bis(4-isopropyl-2-oxazolin-2-yl)-m-xylene]rhodium": 'CC([C@H]1COC(=N1)c1cc(c(cc1C)C)C1=N[C@H](CO1)C(C)C)C.[O-]C(=O)C.[O-]C(=O)C.[Rh+2].O' "Bis(acetonitrile)palladium(II) Dichloride": 'CC#N.CC#N.[Cl-].[Cl-].[Pd+2]' "Bis(benzonitrile)palladium(II) Dichloride": 'N#Cc1ccccc1.N#Cc1ccccc1.[Cl-].[Cl-].[Pd+2]' "Bis(chloromethyl)dimethylsilane": 'ClC[Si](CCl)(C)C' "Bis(dibenzylideneacetone)palladium(0)": 'O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.[Pd]' "Bis(diphenylphosphino)methane": 'c1ccc(cc1)P(c1ccccc1)CP(c1ccccc1)c1ccccc1' "Bis(hexafluoroacetylacetonato)nickel(II) Hydrate": '[O-]/C(=C\C(=O)C(F)(F)F)/C(F)(F)F.[O-]/C(=C\C(=O)C(F)(F)F)/C(F)(F)F.[Ni+2]' "Bis(pentafluorophenyl) Carbonate": 'O=C(Oc1c(F)c(F)c(c(c1F)F)F)Oc1c(F)c(F)c(c(c1F)F)F' "Bis(pentafluorophenyl)dimethylsilane": 'Fc1c(F)c(F)c(c(c1[Si](c1c(F)c(F)c(c(c1F)F)F)(C)C)F)F' "Bis(pentafluorophenyl)phenylphosphine": 'Fc1c(P(c2c(F)c(F)c(c(c2F)F)F)c2ccccc2)c(F)c(c(c1F)F)F' "Bis(pyridine)iodonium Tetrafluoroborate": 'c1cccnc1.F[B-](F)(F)F.[IH+]c1ccccn1' "Bis(tetrabutylammonium) Dichromate": '[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC' "Bis(tri-o-tolylphosphine)palladium(II) Dichloride": 'Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Cc1ccccc1P(c1ccccc1C)c1ccccc1C.[Cl-].[Cl-].[Pd+2]' "Bis(tri-tert-butylphosphine)palladium(0)": 'CC(P(C(C)(C)C)C(C)(C)C)(C)C.CC(P(C(C)(C)C)C(C)(C)C)(C)C.[Pd]' "Bis(trichlorosilyl)acetylene": 'Cl[Si](C#C[Si](Cl)(Cl)Cl)(Cl)Cl' "Bis(tricyclohexylphosphine)nickel(II) Dichloride": 'C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.[Cl-].[Cl-].[Ni+2]' "Bis(tricyclohexylphosphine)palladium(II) Dichloride": 'C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.[Cl-].[Cl-].[Pd+2]' "Bis(trifluoro-2,4-pentanedionato)cobalt(II) Hydrate": 'O=C(C(F)(F)F)/C=C(/C)\[O-].O=C(C(F)(F)F)/C=C(/C)\[O-].[Co+2]' "Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)NS(=O)(=O)C(F)(F)F)(F)F' "Bis(trimethylsilyl) Sulfide": 'C[Si](S[Si](C)(C)C)(C)C' "Bis(trimethylsilyl)acetylene": 'C[Si](C#C[Si](C)(C)C)(C)C' "Bis(trimethylsilyl)bromomethane": 'BrC([Si](C)(C)C)[Si](C)(C)C' "Bis(trimethylsilyl)methane": 'C[Si](C[Si](C)(C)C)(C)C' "Bis(trimethylsilyl)methylamine": 'CN([Si](C)(C)C)[Si](C)(C)C' "Bis(triphenylphosphine)nickel(II) Dichloride": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Ni+2]' "Bis(triphenylphosphine)palladium(II) Diacetate": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[O-]C(=O)C.[O-]C(=O)C.[Pd+2]' "Bis(triphenylphosphine)palladium(II) Dichloride": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Pd+2]' "Bis[1,2-bis(diphenylphosphino)ethane]palladium(0)": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1.[Pd]' "Bis[2-(diphenylphosphino)phenyl] Ether": 'c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1' "Bis[2-(trimethylsilyloxy)ethyl] Ether": 'C[Si](OCCOCCO[Si](C)(C)C)(C)C' "Bis[2-carboxyethylgermanium(IV)] Sesquioxide": 'OC(=O)CC[Ge](=O)O[Ge](=O)CCC(=O)O' "Bis[3-(trimethoxysilyl)propyl]amine": 'CO[Si](CCCNCCC[Si](OC)(OC)OC)(OC)OC' "Bis[di-tert-butyl(4-dimethylaminophenyl)phosphine]palladium(0)": 'CN(c1ccc(cc1)P(C(C)(C)C)C(C)(C)C)C.CN(c1ccc(cc1)P(C(C)(C)C)C(C)(C)C)C.[Pd]' "Bis[tris(2,4-pentanedionato)titanium(IV)] Hexachlorotitanate(IV)": 'Cl[Ti-2](Cl)(Cl)(Cl)(Cl)Cl.[O-]/C(=C/C(=O)C)/C.[O-]/C(=C/C(=O)C)/C.[O-]/C(=C/C(=O)C)/C.[O-]/C(=C/C(=O)C)/C.[O-]/C(=C/C(=O)C)/C.[O-]/C(=C/C(=O)C)/C.[Ti+4].[Ti+4]' "Bismuth Tripotassium Dicitrate": '[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[K+].[K+].[K+].[Bi+5]' "Bisphenol-A": 'CC(c1ccc(cc1)O)(c1ccc(cc1)O)C' "Bistrifluoroacetamide": 'O=C(C(F)(F)F)NC(=O)C(F)(F)F' "BnBr": 'BrCc1ccccc1' "BnCl": 'ClCc1ccccc1' "Bodipy": 'F[B-]1(F)n2cccc2C=C2[N+]1=CC=C2' "Boldine": 'COc1cc2-c3c(OC)c(O)cc4c3C(Cc2cc1O)N(C)CC4' "Borane - 2-Methylpyridine Complex": 'Cc1ccccn1.B' "Borane - 5-Ethyl-2-methylpyridine Complex": 'CCc1ccc(nc1)C.B' "Borane - Ammonia Complex": 'B.N' "Borane - Diisopropylamine Complex": 'CC(NC(C)C)C.B' "Borane - Morpholine Complex": 'C1CNCCO1.B' "Borane - Pyridine Complex": 'c1cccnc1.B' "Borane - Tetrahydrofuran Complex": 'C1CCCO1.B' "Borane -tert-Butylamine Complex": 'CC(N)(C)C.B' "Boron Trichloride": 'ClB(Cl)Cl' "Boron Trifluoride": 'FB(F)F' "Boron Trifluoride - Methanol Reagent": 'FB(F)F.CO' "Boron Trifluoride - Propanol Reagent": 'FB(F)F.CCCO' "Bortezomib": 'CC(CC(B(O)O)NC(=O)C(NC(=O)c1cnccn1)Cc1ccccc1)C' "Bpa": 'CC(c1ccc(cc1)O)(c1ccc(cc1)O)C' "BpyAla": 'NC(C(=O)O)Cc1ccc(nc1)c1ccccn1' "Br-": '[Br-]' "Br2": 'BrBr' "Bradykinin": 'OCC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)O)CCCN=C(N)N)Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C1CCCN1C(=O)C1CCCN1C(=O)C(CCCN=C(N)N)N' "BrdU": 'OCC1OC(CC1O)n1cc(Br)c(=O)[nH]c1=O' "BrdUrd": 'OCC1OC(CC1O)n1cc(Br)c(=O)[nH]c1=O' "Brij-35": 'CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO' "Bromine - 1,4-Dioxane Complex": 'O1CCOCC1.BrBr' "Bromo[(2,6-pyridinediyl)bis(3-methyl-1-imidazolyl-2-ylidene)]nickel Bromide": 'CN1C=CN2C1=[Ni-3](=C1N(C)C=CN1c1nc2ccc1)Br.[Br-]' "Bromo[[1,3-bis[(4S,5S)-1-benzoyl-4,5-diphenyl-2-imidazolin-2-yl]benzene]palladium(II)]": 'O=C(N1C(=N[C@H]([C@@H]1c1ccccc1)c1ccccc1)c1cccc(c1)C1=N[C@H]([C@@H](N1C(=O)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.Br[Pd+]' "Bromoacetic Acid": 'OC(=O)CBr' "Bromocholine Bromide": 'BrCC[N+](C)(C)C.[Br-]' "Bromodicarbonyl[bis[2-(diisopropylphosphino)ethyl]amine]manganese(I)": 'CC(P(C(C)C)CCNCCP(C(C)C)C(C)C)C.[C]=O.[C]=O.[Mn]Br' "Bromodimethylsulfonium Bromide": 'C[S+](Br)C.[Br-]' "Bromopropylate": 'CC(OC(=O)C(c1ccc(cc1)Br)(c1ccc(cc1)Br)O)C' "Bromotrichloromethane": 'ClC(Br)(Cl)Cl' "Bromotripyrrolidinophosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.Br[P+](N1CCCC1)(N1CCCC1)N1CCCC1' "Bromotris(dimethylamino)phosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN([P+](N(C)C)(N(C)C)Br)C' "Brucine": 'COc1cc2c(cc1OC)N1C3C42CCN2C4CC4C3C(CC1=O)OCC=C4C2' "Bu3SnH": 'CCCC[Sn](CCCC)CCCC' "Bu4NBr": 'CCCC[N+](CCCC)(CCCC)CCCC.[Br-]' "Bu4NF": 'CCCC[N+](CCCC)(CCCC)CCCC.[F-]' "Bu4NI": 'CCCC[N+](CCCC)(CCCC)CCCC.[I-]' "BuLi": '[Li]CCCC' "Budesonide": 'CCCC1OC2C(O1)(C(=O)CO)C1(C(C2)C2CCC3=CC(=O)C=CC3(C2C(C1)O)C)C' "Bum": '[CH2]OC(C)(C)C' "Buspirone": 'O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1' "Busulfan": 'CS(=O)(=O)OCCCCOS(=O)(=O)C' "Butein": 'Oc1ccc(c(c1)O)C(=O)C=Cc1ccc(c(c1)O)O' "Butylboronic Acid": 'CCCCB(O)O' "Butylmagnesium Bromide": 'CCCC[Mg]Br' "Butylmagnesium Chloride": 'CCCC[Mg]Cl' "Butyltin Trichloride": 'CCCC[Sn](Cl)(Cl)Cl' "Bz": 'O=[C]c1ccccc1' "Bzf": 'c1ccc2c(c1)occ2' "C-C": 'OP(OCC1OCCC1O)O.OP(OCC1OCCC1O)O' "C-S": 'OCC(C(=O)O)NC(=O)C(CS)N' "C10H10Fe": '[cH-]1cccc1.[cH-]1cccc1.[Fe+2]' "C12": 'CC(CCCCCCCCCCC=CC(=O)O)C' "C2": '[C-]#[C+]' "C21": 'CCCCOC(=O)NS(=O)(=O)c1sc(cc1c1ccc(cc1)Cn1cncc1)CC(C)C' "C2Cl2": 'ClC#CCl' "C2F": 'OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)NCC1CNc2c(N1C)c(=O)nc([nH]2)N' "C2H2": 'C#C' "C2H4": 'C=C' "C2H4O2": 'CC(=O)O' "C2H5BrMg": 'CC[Mg]Br' "C2H5ClMg": 'CC[Mg]Cl' "C2H5Li": '[Li]CC' "C2H6BrCuS": 'CSC.[Cu+].[Br-]' "C2H6MgO2": '[O-]C.[O-]C.[Mg+2]' "C2H6O": 'CCO' "C2H9BS": 'CSC.B' "C2HCl3": 'ClC=C(Cl)Cl' "C3H5ClO": 'CCC(=O)Cl' "C3H8O": 'CCCO' "C40H52O4": 'CC(=CC=CC=C(C=CC=C(C=CC1=C(C)C(=O)C(CC1(C)C)O)C)C)C=CC=C(C=CC1=C(C)C(=O)C(CC1(C)C)O)C' "C4Cl6": 'ClC(=C(Cl)Cl)C(=C(Cl)Cl)Cl' "C4H11BO": 'C1CCCO1.B' "C4H8O": 'C1CCCO1' "C4H9Li": '[Li]CCCC' "C4H9MgBr": 'CCCC[Mg]Br' "C4H9MgCl": 'CCCC[Mg]Cl' "C4MIM": 'CCCCn1cc[n+](c1)C' "C5H10": 'C1CCCC1' "C5H12": 'CCCCC' "C5H5N": 'c1cccnc1' "C5H5N SO3": 'c1cccnc1.O=S(=O)=O' "C5H8BN": 'c1cccnc1.B' "C6": 'OCC1OC(OP(=O)(OP(=O)(OCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(C)C)C)C)C)C)C)C)C)C)C)C)O)O)C(C(C1OC1OC(CO)C(C(C1NC(=O)C)O)O)OC(C(=O)NC(C(=O)NC(C(=O)O)CCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)C)C)CCCC(C(=O)O)N)C)C)NC(=O)C' "C6-ceramide": 'CCCCCCCCCCCCCC=CC(C(NC(=O)CCCCC)CO)O' "C60": 'c12c3c4c5c2c2c6c7c1c1c8c3c3c9c4c4c%10c5c5c2c2c6c6c%11c7c1c1c7c8c3c3c8c9c4c4c9c%10c5c5c2c2c6c6c%11c1c1c7c3c3c8c4c4c9c5c2c2c6c1c3c42' "C6H12": 'C1CCCCC1' "C6H14": 'CCCCCC' "C6H5I": 'Ic1ccccc1' "C6H6": 'c1ccccc1' "C7": 'NCCCCC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(=O)C(NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(Cc1ccccc1)N)CC(C)C)CC(C)C)Cc1c[nH]c2c1cccc2)CCC(=O)N)CCC(=O)N)NC(=O)C1CCCN1C(=O)C(NC(=O)C1CCCN1C(=O)CNC(=O)C(NC(=O)C(NC(=O)C(Cc1ccc(cc1)O)NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(C(O)C)NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)CN)CC(C)C)CC(=O)N)CO)C)CC(C)C)CC(C)C)CCCN=C(N)N' "C7H8": 'Cc1ccccc1' "C8E4": 'CCCCCCCCOCCOCCOCCOCCO' "C8F17I": 'FC(C(C(C(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F' "CA": 'N#Cc1c2ccccc2cc2c1cccc2' "CAAP": 'Nc1cc(Cl)nc(n1)N' "CAF": 'OCC(C(c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl' "CAN": '[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[Ce+4].[NH4+]' "CAPE": 'O=C(C=Cc1ccc(c(c1)O)O)OCCc1ccccc1' "CB7": 'OC1CC(O)(C(=O)O)C(=C(C1O)OCc1ccc2c(c1)ccs2)Cc1ccc2c(c1)ccs2' "CBDP": 'Cc1ccccc1OP1(=O)OCc2c(O1)cccc2' "CBP": 'c1ccc2c(c1)n(c1ccc(cc1)c1ccc(cc1)n1c3ccccc3c3c1cccc3)c1c2cccc1' "CBX": 'O=C(C1=C(C)OCCS1)Nc1ccccc1' "CBiPES": 'N#Cc1ccc(cc1)c1cccc(c1)N(S(=O)(=O)CC)Cc1cccnc1' "CBr4": 'BrC(Br)(Br)Br' "CBrCl3": 'ClC(Br)(Cl)Cl' "CCl4": 'ClC(Cl)(Cl)Cl' "CD3CN": 'CC#N' "CD3OD": 'CO' "CDCA": 'OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)O)C)C)O)C' "CDCF": 'OC(=O)c1ccc2c(c1)C(=O)OC12c2cc(Cl)c(cc2Oc2c1cc(Cl)c(c2)O)O' "CDCl3": 'ClC(Cl)Cl' "CDI": 'O=C(n1cncc1)n1cncc1' "CDMT": 'COc1nc(OC)nc(n1)Cl' "CDNCB": '[O-][N+](=O)c1cc(C(=O)O)c(c(c1)[N+](=O)[O-])Cl' "CDP": 'OC1C(COP(=O)(OP(=O)(O)O)O)OC(C1O)n1ccc(nc1=O)N' "CDPPB": 'N#Cc1cccc(c1)C(=O)Nc1cc(nn1c1ccccc1)c1ccccc1' "CDT": 'O=C(n1ncnc1)n1ncnc1' "CE-OOH": 'OOC1CCC2(C(=CCC3C2CCC2(C3CCC2C(CCCC(C)C)C)C)C1)C' "CF2Cl2": 'FC(Cl)(Cl)F' "CF3CH2OH": 'OCC(F)(F)F' "CF3COOH": 'OC(=O)C(F)(F)F' "CF3Cl": 'FC(Cl)(F)F' "CF3O": '[O]C(F)(F)F' "CF3O2": '[O]OC(F)(F)F' "CFCl3": 'FC(Cl)(Cl)Cl' "CGA": 'ClCC[Si](OCCOC)(OCCOC)OCCOC' "CGP": 'OCC1OC(CC1O)n1cnc2c1[nH]c(N)nc2=O' "CH2CN": '[CH2]C#N' "CH2Cl2": 'ClCCl' "CH2NH2": '[CH2]N' "CH2NO2": '[O-][N+](=O)C' "CH2O": 'C=O' "CH2OH": '[CH2]O' "CH3BrMg": 'C[Mg]Br' "CH3CH(OEt)2": 'CCOC(OCC)C' "CH3CH(OMe)2": 'COC(OC)C' "CH3CN": 'CC#N' "CH3I": 'CI' "CH3Li LiBr": '[Li]C.[Li+].[Br-]' "CH3LiO": '[O-]C.[Li+]' "CH3MgCl": 'C[Mg]Cl' "CH3MgI": 'C[Mg]I' "CH3NH2": 'CN' "CH3NO2": '[O-][N+](=O)C' "CH3NaS": '[S-]C.[Na+]' "CH3OH": 'CO' "CH3SO3H": 'CS(=O)(=O)O' "CH4": 'C' "CHBr2": 'Br[CH]Br' "CHBr3": 'BrC(Br)Br' "CHBrCl2": 'ClC(Br)Cl' "CHCl3": 'ClC(Cl)Cl' "CHClBr2": 'ClC(Br)Br' "CHI3": 'IC(I)I' "CHPG": 'OC(=O)C(c1cc(O)ccc1Cl)N' "CI4": 'IC(I)(I)I' "CIQ": 'COc1ccc(cc1)OCC1c2cc(OC)c(cc2CCN1C(=O)c1cccc(c1)Cl)OC' "CITCO": 'Clc1ccc(cc1)c1nc2n(c1C=NOCc1ccc(c(c1)Cl)Cl)ccs2' "CITIPT": 'CC(O[Ti](OC(C)C)(OC(C)C)Cl)C' "CMBP": 'CCCCP(=CC#N)(CCCC)CCCC' "CMF": 'ClCc1ccc(o1)C=O' "CMMP": 'N#CC=P(C)(C)C' "CMPI": 'Clc1cccc[n+]1C.[I-]' "CN": 'N#Cc1cccc2c1cccc2' "CNBr": 'BrC#N' "CNO": 'O=C(Cc1ccc(cc1)OC(C(=O)O)(C)C)Nc1cccc(c1)NC(=O)Cc1ccc(cc1)OC(C(=O)O)(C)C' "CNQX": 'N#Cc1cc2[nH]c(=O)c(=O)[nH]c2cc1[N+](=O)[O-]' "CO": '[C-]#[O+]' "CO2": 'O=C=O' "COC": 'COC(=O)C1C(CC2N(C1CC2)C)OC(=O)c1ccccc1' "COD": 'C1CC=CCCC=C1' "COOH": 'CCCc1cc(ccc1OCCc1cc2c([nH]1)ccc(c2)CC(=O)O)Oc1ccccc1' "CORM-2": 'Cl[Ru]Cl.Cl[Ru]Cl.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]' "CORTISOL": 'OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C' "COT": 'C1=CC=CC=CC=C1' "COU": 'O=c1ccc2c(o1)cccc2' "CP-2": 'CC1=CC2=C(C(O1)O)C=C1C(O2)CC(CC1)C(Cn1cnc(c2-c1ncn2)N)C' "CPF": 'Fc1cc2c(cc1N1CCNCC1)n(cc(c2=O)C(=O)O)C1CC1' "CPMA": 'ClC(=[N+](C)C)Sc1ccccc1.[Cl-]' "CPME": 'COC1CCCC1' "CPPHA": 'Clc1ccc(c(c1)CN1C(=O)c2c(C1=O)cccc2)NC(=O)c1ccccc1O' "CRM": 'OCC(C(C(Cn1c(=O)c(CCC(=O)O)nc2c1[nH]c(=O)[nH]c2=O)O)O)O' "CSA": 'O=C1CC2C(C1(CC2)CS(=O)(=O)O)(C)C' "CSI": 'O=C=NS(=O)(=O)Cl' "CTAB": 'CCCCCCCCCCCCCCCC[N+](C)(C)C.[Br-]' "CTAC": 'CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]' "CTM": 'CN(CCn1nnnc1SCC1=C(C(=O)O)N2C(SC1)C(C2=O)NC(=O)Cc1csc(n1)N)C' "CTMABC": '[O-][Cr](=O)(=O)Br.CCCCCCCCCCCCCCCC[N+](C)(C)C' "CTMS": 'C[Si](Cl)(C)C' "CTPB": 'CCCCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.[Br-]' "CUB": '[Cu]' "CVN": 'O=c1[nH]oc2c1c(ccc2)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F' "CXM": 'CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)[O-])COC(=O)N)c1ccco1.[Na+]' "CYA": 'CC=CCC(C(C1C(=O)NC(CC)C(=O)N(C)CC(=O)N(C)C(CC(C)C)C(=O)NC(C(C)C)C(=O)N(C)C(CC(C)C)C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C' "CYT": 'Nc1ccnc(=O)[nH]1' "CaBr2 H2O": '[Ca+2].[Br-].[Br-].O' "CaCO3": '[O-]C(=O)[O-].[Ca+2]' "CaCl2": '[Cl-].[Cl-].[Ca+2]' "CaF": 'OCC(C(c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl' "CaH2": '[H-].[H-].[Ca+2]' "CaLac": '[O-]C(=O)C.[O-]C(=O)C.[Ca+2]' "CaO2": '[O-][O-].[Ca+2]' "CaSO4": '[O-]S(=O)(=O)[O-].[Ca+2]' "Cacodylic Acid": 'C[As](=O)(O)C' "Caf": 'OCC(C(c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl' "Caffeine": 'Cn1cnc2c1c(=O)n(C)c(=O)n2C' "Calcein-AM": 'O=C(CN(Cc1c(ccc2c1Oc1c(CN(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)c(ccc1C12OC(=O)c2c1cccc2)OC(=O)C)OC(=O)C)CC(=O)OCOC(=O)C)OCOC(=O)C' "CalciumL-Threonate": 'OC[C@@H]([C@H](C(=O)[O-])O)O.OC[C@@H]([C@H](C(=O)[O-])O)O.[Ca+2]' "Camphor": 'O=C1CC2C(C1(C)CC2)(C)C' "Camptosar": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(cc4c(c3Cn1c2=O)CC)OC(=O)N1CCC(CC1)N1CCCCC1' "Camptothecin": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O' "Camptothecine": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O' "Canagliflozin": 'OCC1OC(c2ccc(c(c2)Cc2ccc(s2)c2ccc(cc2)F)C)C(C(C1O)O)O' "Candesartan": 'CCOc1nc2c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)c(ccc2)C(=O)O' "Cannabidiol": 'CCCCCc1cc(O)c(c(c1)O)C1C=C(C)CCC1C(=C)C' "Cannabinol": 'CCCCCc1cc(O)c2-c3cc(C)ccc3C(Oc2c1)(C)C' "Cantharidin": 'O=C1OC(=O)C2(C1(C)C1CCC2O1)C' "Caprelsa": 'COc1cc2c(ncnc2cc1OCC1CCN(CC1)C)Nc1ccc(cc1F)Br' "Captopril": 'SCC(C(=O)N1CCCC1C(=O)O)C' "Carbachol": 'NC(=O)OCC[N+](C)(C)C.[Cl-]' "Carbamylcholine Chloride": 'NC(=O)OCC[N+](C)(C)C.[Cl-]' "Carbaryl": 'CNC(=O)Oc1cccc2c1cccc2' "Carbocyanine": 'CCN1C(=CC=Cc2ccc3c([n+]2CC)cccc3)C=Cc2c1cccc2.[I-]' "Carbon Tetrabromide": 'BrC(Br)(Br)Br' "Carbon Tetraiodide": 'IC(I)(I)I' "Carbonyl(dihydrido)tris(triphenylphosphine)ruthenium(II)": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[C]=O.[RuH2]' "Carbonylchlorobis(triphenylphosphine)iridium(I)": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[C]=O.Cl[Ir]' "Carbonylhydridotris(triphenylphosphine)iridium(I)": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[C]=O.[IrH]' "Carbopol": 'OC(=O)C=C' "Cardamonin": 'COc1cc(O)cc(c1C(=O)C=Cc1ccccc1)O' "Cardiolipin": 'CCCCCCCCCCCCCCCCCC(=O)OC(COP(=O)(OCC(COP(=O)(OCC(OC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)O)O)O)COC(=O)CCCCCCCCCCCCCCCCC' "Carnosine": 'NCCC(=O)NC(C(=O)O)Cc1[nH]cnc1' "Carvacrol": 'CC(c1ccc(c(c1)O)C)C' "Carvone": 'CC(=C)C1CC=C(C(=O)C1)C' "Catalpol": 'OCC1OC(OC2OC=CC3C2C2(CO)OC2C3O)C(C(C1O)O)O' "Catapresan": 'Clc1cccc(c1NC1=NCCN1)Cl' "Catechin": 'Oc1cc2OC(c3ccc(c(c3)O)O)C(Cc2c(c1)O)O' "Catechol": 'Oc1ccccc1O' "CdCl2": 'Cl[Cd]Cl' "CdH2O2": '[Cd+2].[OH-].[OH-]' "CdTe": '[Cd]=[Te]' "Ce(OH)4": '[Ce+4].[OH-].[OH-].[OH-].[OH-]' "CeH3O3": '[Ce+3].[OH-].[OH-].[OH-]' "CeO2": 'O=[Ce]=O' "Celastrol": 'O=C1C=C2C(=CC=C3C2(C)CCC2(C3(C)CCC3(C2CC(C)(CC3)C(=O)O)C)C)C(=C1O)C' "Celecoxib": 'Cc1ccc(cc1)c1cc(nn1c1ccc(cc1)S(=O)(=O)N)C(F)(F)F' "Cepharanthine": 'COc1cc2CCN(C3c2cc1Oc1c2c(CCN(C2Cc2ccc(Oc4cc(C3)ccc4OC)cc2)C)cc2c1OCO2)C' "Cerium": '[Ce]' "Cerium(III) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Ce+3]' "Cetrorelix": 'OCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1CCCC1C(=O)NC(C(=O)N)C)CCCN=C(N)N)CC(C)C)CCCNC(=O)N)Cc1ccc(cc1)O)NC(=O)C(Cc1cccnc1)NC(=O)C(Cc1ccc(cc1)Cl)NC(=O)C(Cc1ccc2c(c1)cccc2)NC(=O)C' "Chalcone": 'O=C(c1ccccc1)C=Cc1ccccc1' "Chelerythrine": 'COc1c(OC)ccc2c1c[n+](C)c1c2ccc2c1cc1OCOc1c2' "Chelidonine": 'CN1Cc2c(C3C1c1cc4OCOc4cc1CC3O)ccc1c2OCO1' "Chiraphos": 'C[C@H](P(c1ccccc1)c1ccccc1)[C@@H](P(c1ccccc1)c1ccccc1)C' "Chl": 'COC(=O)C1C2=C3[NH+]=C(C(C3CCC(=O)OCC=C(CCCC(CCCC(CCCC(C)C)C)C)C)C)C=c3[n-]c(=CC4=[NH+]C(=Cc5[n-]c2c(C1=O)c5C)C(=C4C=O)CC)c(c3C)C=C.[Mg+2]' "Chloramine B Hydrate": 'Cl[N-]S(=O)(=O)c1ccccc1.[Na+].O' "Chloramine T Trihydrate": 'Cl[N-]S(=O)(=O)c1ccc(cc1)C.[Na+].O.O.O' "Chloranil": 'ClC1=C(Cl)C(=O)C(=C(C1=O)Cl)Cl' "Chlordecone": 'O=C1C2(Cl)C3(C4(C1(Cl)C1(C2(C3(Cl)C(C41Cl)(Cl)Cl)Cl)Cl)Cl)Cl' "Chloro(1,5-cyclooctadiene)iridium(I)": 'C1CC=CCCC=C1.Cl[Ir]' "Chloro(1,5-cyclooctadiene)rhodium(I)": 'C1CC=CCCC=C1.Cl[Rh]' "Chloro(1,5-hexadiene)rhodium(I)": 'C=CCCC=C.Cl[Rh]' "Chloro(3-chloropropyl)dimethylsilane": 'ClCCC[Si](Cl)(C)C' "Chloro(hexyl)dimethylsilane": 'CCCCCC[Si](Cl)(C)C' "Chloro(methyl)(phenyl)(vinyl)silane": 'C=C[Si](c1ccccc1)(Cl)C' "Chloro(pentamethylcyclopentadienyl)ruthenium(II)": 'Cl[Ru]C1=C(C)C(=C(C1(C)C)C)C' "Chloro-N,N,N',N'-tetramethylformamidinium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN(C(=[N+](C)C)Cl)C' "Chloro[(tri-tert-butylphosphine)-2-(2-aminobiphenyl)]palladium(II)": 'CC(P(C(C)(C)C)(C(C)(C)C)Cl)(C)C.N[C]1(=CC=CC=C1c1ccccc1)[Pd+2]' "Chloro[1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene]copper(I)": 'Cl[Cu-2]=c1n(ccn1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C' "Chloro[[1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene](N,N-dimethyl-3,5-dimethoxybenzylamine)palladium(II)]": 'Cl[Pd-]=c1n(ccn1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C.COc1cc(CN(C)C)cc(c1)OC' "Chloro[[1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene](N,N-dimethylbenzylamine)palladium(II)]": 'CN(Cc1ccccc1)C.Cl[Pd-]=c1n(ccn1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C' "Chloro[[1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene](acetanilide)palladium(II)]": 'CC(=O)Nc1ccccc1.Cl[Pd-]=c1n(ccn1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C' "Chloroacetic Acid": 'OC(=O)CCl' "Chlorobis(cyclooctene)iridium(I)": 'C1CCCC=CCC1.C1CCCC=CCC1.Cl[Ir]' "Chlorobis(cyclooctene)rhodium(I)": 'C1CCCC=CCC1.C1CCCC=CCC1.Cl[Rh]' "Chlorobis(ethylene)iridium(I)": 'Cl[Ir-4]12(CC2)CC1' "Chlorobis(ethylene)rhodium(I)": 'Cl[Rh-4]12(CC2)CC1' "Chlorobis[dicyclohexyl(phenyl)phosphino](o-tolyl)nickel(II)": 'Cc1ccccc1[Ni-2](P(c1ccccc1)(C1CCCCC1)C1CCCCC1)(P(c1ccccc1)(C1CCCCC1)C1CCCCC1)Cl' "Chlorocholine Chloride": 'ClCC[N+](C)(C)C.[Cl-]' "Chlorodicyclohexylphosphine": 'ClP(C1CCCCC1)C1CCCCC1' "Chlorodifluoroacetic Acid": 'OC(=O)C(Cl)(F)F' "Chlorodiisopropylphosphine": 'CC(P(C(C)C)Cl)C' "Chlorodimethylvinylsilane": 'C=C[Si](Cl)(C)C' "Chlorodiphenylphosphine": 'ClP(c1ccccc1)c1ccccc1' "Chloromethyldimethylphenylsilane": 'ClC[Si](c1ccccc1)(C)C' "Chloronitrosyl[N,N'-bis(3,5-di-tert-butylsalicylidene)-1,1,2,2-tetramethylethylenediaminato]ruthenium(IV)": '[O-]c1c(/C=N/C(C(/N=C/c2cc(cc(c2[O-])C(C)(C)C)C(C)(C)C)(C)C)(C)C)cc(cc1C(C)(C)C)C(C)(C)C.[N-]=O.[Cl-].[Ru+4]' "Chloropentamethyldisilane": 'C[Si]([Si](C)(C)C)(Cl)C' "Chlorophyll-a": 'COC(=O)C1C2=c3c(=C1[O-])c(c([n-]3)C=C1N=C(C(=C1CC)C)C=C1N=C(C=C3N=C2C(CCC(=O)OCC=C(CCCC(CCCC(CCCC(C)C)C)C)C)C3C)C(=C1C=C)C)C.[Mg+2]' "Chloroquine": 'CCN(CCCC(Nc1ccnc2c1ccc(c2)Cl)C)CC' "Chlorothalonil": 'N#Cc1c(Cl)c(C#N)c(c(c1Cl)Cl)Cl' "Chlorotriethoxysilane": 'CCO[Si](OCC)(OCC)Cl' "Chlorotripyrrolidinophosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.Cl[P+](N1CCCC1)(N1CCCC1)N1CCCC1' "Chlorpyrifos": 'CCOP(=S)(Oc1nc(Cl)c(cc1Cl)Cl)OCC' "Cholane": 'CCCC(C1CCC2C1(C)CCC1C2CCC2C1(C)CCCC2)C' "Cholesterol": 'CC(CCCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O)C)C' "Choline": 'OCC[N+](C)(C)C' "Choline Chloride": 'OCC[N+](C)(C)C.[Cl-]' "Chromium": '[Cr]' "Chrysin": 'Oc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1' "Chrysoeriol": 'COc1cc(ccc1O)c1cc(=O)c2c(o1)cc(cc2O)O' "Ciguatoxin": 'OCC(C=CC1C=CCC2C(O1)C(O)C1C(O2)CC2C(O1)C=CC1C(O2)C=CC2C(O1)CC=CCC1C(O2)CC(O)C2(C(O1)CC1C(O2)CC(C)CC2C(O1)CC1OC3C(C(C(C1O2)C)O)OC1(C(C3C)C)OCC(C1)O)C)O' "Cilnidipine": 'COCCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCC=Cc1ccccc1)C' "Cilostazol": 'O=C1CCc2c(N1)ccc(c2)OCCCCc1nnnn1C1CCCCC1' "Cimetidine": 'N#CNC(=NC)NCCSCc1nc[nH]c1C' "Cinchonidine": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1ccnc2c1cccc2)O' "Cinchonidine Dihydrochloride": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1ccnc2c1cccc2)O.Cl.Cl' "Cinchonidine Sulfate Dihydrate": 'OS(=O)(=O)O.C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1ccnc2c1cccc2)O.O.O' "Cinchonine": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1ccnc2c1cccc2)O' "Cinchonine Hydrochloride Hydrate": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1ccnc2c1cccc2)O.Cl.O' "Cinnamaldehyde": 'O=CC=Cc1ccccc1' "Cinobufagin": 'OC1CCC2(C(C1)CCC1C2CCC2(C31OC3C(C2c1ccc(=O)oc1)OC(=O)C)C)C' "Ciprofloxacin": 'Fc1cc2c(cc1N1CCNCC1)n(cc(c2=O)C(=O)O)C1CC1' "Cis-hinokiresinol": 'C=CC(c1ccc(cc1)O)C=Cc1ccc(cc1)O' "Citalopram": 'N#Cc1ccc2c(c1)COC2(CCCN(C)C)c1ccc(cc1)F' "Citric Acid": 'OC(=O)C(CC(=O)O)(CC(=O)O)O' "Citrinin": 'CC1OC=C2C(=C(C)C(=C(C2=O)C(=O)O)O)C1C' "Citronellal": 'O=CCC(CCC=C(C)C)C' "Cl-": '[Cl-]' "Cl2": 'ClCl' "ClU": 'Clc1cccc(c1NC1NCCN1)Cl' "Clonazepam": 'O=C1CN=C(c2c(N1)ccc(c2)[N+](=O)[O-])c1ccccc1Cl' "Clonidine": 'Clc1cccc(c1NC1=NCCN1)Cl' "Clopidogrel": 'COC(=O)C(c1ccccc1Cl)N1CCc2c(C1)ccs2' "Clothianidin": '[O-][N+](=O)NC(=NC)NCc1cnc(s1)Cl' "Clozapine": 'CN1CCN(CC1)C1=c2ccccc2=Nc2c(N1)cc(Cl)cc2' "Co": '[Co]' "Co(OH)2": '[Co+2].[OH-].[OH-]' "Co(OH)3": '[Co+3].[OH-].[OH-].[OH-]' "Co2CO8": '[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH-]=O.[CH-]=O.[Co].[Co+2]' "CoQ10": 'COC1=C(OC)C(=O)C(=C(C1=O)CC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(C)C)C)C)C)C)C)C)C)C)C)C' "Coal": '[Al]#[Co]' "Cobalt": '[Co]' "Cobicistat": 'O=C(NC(Cc1ccccc1)CCC(Cc1ccccc1)NC(=O)C(NC(=O)N(Cc1csc(n1)C(C)C)C)CCN1CCOCC1)OCc1cncs1' "Cocaine": 'COC(=O)C1C(CC2N(C1CC2)C)OC(=O)c1ccccc1' "Coelenterazine": 'Oc1ccc(cc1)Cc1nc2-n(c1=O)cc([nH]c2Cc1ccccc1)c1ccc(cc1)O' "Colchicine": 'COc1c(OC)cc2c(-c3ccc(c(=O)cc3C(CC2)NC(=O)C)OC)c1OC' "Confluentin": 'CC(=CCCC1(C)C=Cc2c(O1)cc(cc2O)C)CCC=C(C)C' "Copper": '[Cu]' "Copper(I) 2-Thiophenecarboxylate": '[O-]C(=O)c1cccs1.[Cu+]' "Copper(I) Acetate": '[O-]C(=O)C.[Cu+]' "Copper(I) Cyanide": '[C-]#N.[Cu+]' "Copper(I) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.[Cu+]' "Copper(I) Trifluoromethanethiolate": '[S-]C(F)(F)F.[Cu+]' "Copper(II) Acetate Monohydrate": '[O-]C(=O)C.[O-]C(=O)C.[Cu+2].O' "Copper(II) Tetrafluoroborate": 'F[B-](F)(F)F.F[B-](F)(F)F.[Cu+2]' "Copper(II) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Cu+2]' "Corticosterone": 'OCC(=O)C1CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C' "Cortisol": 'OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C' "Cotinine": 'O=C1CCC(N1C)c1cccnc1' "Coumarin": 'O=c1ccc2c(o1)cccc2' "Coumarin-500": 'CCNc1ccc2c(c1)oc(=O)cc2C(F)(F)F' "Cp": 'C1C=CC=C1' "Cp*": 'CC1=[C]C(C(=C1C)C)(C)C' "Cr(OH)3": '[Cr+3].[OH-].[OH-].[OH-]' "Cr3": '[O-]c1c(cccc1C1C=c2c(=[NH+]1)ccc(c2)C(=[NH2+])N)OC1CCCC1' "CrB": 'OC1C(CP(=O)(O)O)CC(CC1O)(O)C(=O)O' "CrO3": '[O-2].[O-2].[O-2].[Cr+6]' "Creatine": 'OC(=O)CN(C(=N)N)C' "Creatinine": 'O=C1N=C(N(C1)C)N' "Crizotinib": 'Nc1ncc(cc1OC(c1c(Cl)ccc(c1Cl)F)C)c1cnn(c1)C1CCNCC1' "Crocin": 'OCC1OC(OCC2OC(OC(=O)C(=CC=CC(=CC=CC=C(C=CC=C(C(=O)OC3OC(COC4OC(CO)C(C(C4O)O)O)C(C(C3O)O)O)C)C)C)C)C(C(C2O)O)O)C(C(C1O)O)O' "Croconic Acid": 'OC1=C(O)C(=O)C(=O)C1=O' "Crotonaldehyde": 'CC=CC=O' "Cs2CO3": '[O-]C(=O)[O-].[Cs+].[Cs+]' "Cs2SO4": '[O-]S(=O)(=O)[O-].[Cs+].[Cs+]' "CsBr": '[Br-].[Cs+]' "CsCl": '[Cl-].[Cs+]' "CsF": '[F-].[Cs+]' "CsI": '[I-].[Cs+]' "CsOH": '[Cs+].[OH-]' "Cu": '[Cu]' "Cu(OH)2": '[Cu+2].[OH-].[OH-]' "Cu-Pulver": 'Cu' "Cu-powder": 'Cu' "Cu2O": '[O-2].[Cu+].[Cu+]' "CuBr": '[Cu+].[Br-]' "CuBr DMS": 'CSC.[Cu+].[Br-]' "CuBr-DMS": 'CSC.[Cu+].[Br-]' "CuBr.DMS": 'CSC.[Cu+].[Br-]' "CuBr.Me2S": 'CSC.[Cu+].[Br-]' "CuBr2": '[Cu+2].[Br-].[Br-]' "CuCN": '[C-]#N.[Cu+]' "CuCl": '[Cl-].[Cu+]' "CuCl2": '[Cl-].[Cl-].[Cu+2]' "CuF2": '[F-].[F-].[Cu+2]' "CuI": '[Cu+].[I-]' "CuI2": '[Cu+2].[I-].[I-]' "CuO": 'O=[Cu]' "CuSO4": '[O-]S(=O)(=O)[O-].[Cu+2]' "CuSO4* 5 H2O": '[O-]S(=O)(=O)[O-].[Cu+2].O.O.O.O.O' "Cubebin": 'OC1OCC(C1Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2' "Cumene Hydroperoxide": 'OOc1ccc(cc1)C(C)C' "Curcumin": 'COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(c(c2)OC)O)ccc1O' "Cyanidin": 'Oc1cc(O)c2c(c1)[o+]c(c(c2)O)c1ccc(c(c1)O)O' "Cyanomethylenetributylphosphorane": 'CCCCP(=CC#N)(CCCC)CCCC' "Cyanuric Chloride": 'Clc1nc(Cl)nc(n1)Cl' "Cycloheximide": 'CC1CC(C)C(=O)C(C1)C(CC1CC(=O)NC(=O)C1)O' "Cyclohexyl(dimethoxy)methylsilane": 'CO[Si](C1CCCCC1)(OC)C' "Cyclohexylboronic Acid": 'OB(C1CCCCC1)O' "Cyclohexyldiphenylphosphine": 'C1CCC(CC1)P(c1ccccc1)c1ccccc1' "Cyclohexylmagnesium Bromide": 'Br[Mg]C1CCCCC1' "Cyclohexyltrimethylammonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.C[N+](C1CCCCC1)(C)C' "Cyclooctene": 'C1CCCC=CCC1' "Cyclopentadienyl Thallium": '[Tl]C1=CC=CC1' "Cyclopentadienylbis(triphenylphosphine)ruthenium(II) Chloride": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Ru+]C1=CC=CC1.[Cl-]' "Cyclopentadienyliron Dicarbonyl Dimer": '[Fe]C1=CC=CC1.[C]=O.[C]=O' "Cyclopentadienyltitanium(IV) Trichloride": '[Ti+3]C1=CC=CC1.[Cl-].[Cl-].[Cl-]' "Cyclopentylboronic Acid": 'OB(C1CCCC1)O' "Cyclopentylmagnesium Bromide": 'Br[Mg]C1CCCC1' "Cyclophosphamide": 'ClCCN(P1(=O)NCCCO1)CCCl' "Cyclopropylmagnesium Bromide": 'Br[Mg]C1CC1' "Cyfluthrin": 'N#CC(c1ccc(c(c1)Oc1ccccc1)F)OC(=O)C1C(C1(C)C)C=C(Cl)Cl' "Cynaropicrin": 'OCC(=C)C(=O)OC1CC(=C)C2C(C3C1C(=C)C(=O)O3)C(=C)C(C2)O' "Cypermethrin": 'N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)C=C(Cl)Cl' "Cyprodinil": 'Cc1nc(Nc2ccccc2)nc(c1)C1CC1' "Cys": 'N[C@H](C(=O)O)CS' "CysNO": 'O=NSCC(C(=O)O)N' "Cysteamine": 'NCCS' "Cyt": 'Nc1ccnc(=O)[nH]1' "Cytarabine": 'OCC1OC(C(C1O)O)n1ccc(nc1=O)N' "Cytisine": 'O=c1cccc2n1CC1CNCC2C1' "D-(+)-Threonine": 'C[C@@H]([C@H](C(=O)O)N)O' "D-(-)-Leucinol": 'OC[C@@H](CC(C)C)N' "D-Ala-D-Ala": 'CC(C(=O)O)NC(=O)C(N)C' "D-Alanine": 'C[C@H](C(=O)O)N' "D-Methionine": 'CSCC[C@H](C(=O)O)N' "D-Orn": 'NC(C(=O)O)CCCN' "D-Phe": 'NC(C(=O)O)Cc1ccccc1' "D-Phenylalanine": 'N[C@@H](C(=O)O)Cc1ccccc1' "D-Pipecolic Acid": 'OC(=O)C1CCCCN1' "D-Proline": 'OC(=O)[C@H]1CCCN1' "D-Serine": 'OCC(C(=O)O)N' "D-Tryptophan": 'OC(=O)[C@@H](Cc1c[nH]c2c1cccc2)N' "D-alanine": 'CC(C(=O)O)N' "D-amphetamine": 'CC(Cc1ccccc1)N' "D-cycloserine": 'NC1CONC1=O' "D-fagomine": 'OCC1NCCC(C1O)O' "D-fructose": 'OCC1(O)OCC(C(C1O)O)O' "D-galactose": 'OCC1OC(O)C(C(C1O)O)O' "D-limonene": 'CC1=CCC(CC1)C(=C)C' "D-ornithine": 'NC(C(=O)O)CCCN' "D-penicillamine": 'NC(C(S)(C)C)C(=O)O' "D-serine": 'OCC(C(=O)O)N' "D-valine": 'NC(C(=O)O)C(C)C' "D2": '[HH]' "D2O": 'O' "DABCO": 'C1CN2CCN1CC2' "DACA": 'CN(CCNC(=O)c1cccc2c1nc1ccccc1c2)C' "DADO": 'O/N=C(/C(=N/O)/C)\C' "DAGA": 'CC(=O)Nc1ccc(cc1)O' "DAIB": 'CC(=O)Oc1c(cccc1I)OC(=O)C' "DAM": 'CC(=NO)C(=O)C' "DAMGO": 'OCCNC(=O)C(N(C(=O)CNC(=O)C(NC(=O)C(Cc1ccc(cc1)O)N)C)C)Cc1ccccc1' "DAMN": 'N#C/C(=C(\C#N)/N)/N' "DAP": '[N-]=[N+]=CCC' "DAPI": 'NC(=N)c1ccc(cc1)c1cc2c([nH]1)cc(cc2)C(=N)N' "DAPTA": 'OCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N)C(O)C)Cc1ccc(cc1)O)CC(=O)N)C(O)C)C(O)C)C(O)C)NC(=O)C(N)C' "DAST": 'CCN(S(F)(F)F)CC' "DBA": 'Brc1c2ccccc2c(c2c1cccc2)Br' "DBAD": 'O=C(OC(C)(C)C)/N=N/C(=O)OC(C)(C)C' "DBAD-H2": 'NN(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C' "DBB": 'CC(c1ccc(cc1)c1ccc(cc1)C(C)(C)C)(C)C' "DBCP": 'ClCC(CBr)Br' "DBEDA": 'N(=C\c1ccccc1)/CC/N=C/c1ccccc1' "DBMP": 'CCCCOP(=O)(OCCCC)C' "DBN": 'C1CN=C2N(C1)CCC2' "DBNE": 'CCCCN(C(C(c1ccccc1)O)C)CCCC' "DBPO, BPO": 'O=C(c1ccccc1)OOC(=O)c1ccccc1' "DBTDL": 'CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCC[Sn+2]CCCC' "DBTO": 'O=s1c2ccccc2c2c1cccc2' "DBU": 'C1N=CC2N(CC1)CCCC2' "DCA": 'N#Cc1cccc2c1c(C#N)c1c(c2)cccc1' "DCB": 'C1CCC(CC1)BC1CCCCC1' "DCBN": 'NC(=S)c1c(Cl)cccc1Cl' "DCC": 'C1CCC(CC1)N=C=NC1CCCCC1' "DCE": 'ClCCCl' "DCFDA": 'CC(=O)Oc1cc2Oc3cc(OC(=O)C)c(cc3C3(c2cc1Cl)OC(=O)c1c3cccc1)Cl' "DCFH-DA": 'CC(=O)Oc1cc2Oc3cc(OC(=O)C)c(cc3C3(c2cc1Cl)OC(=O)c1c3cccc1)Cl' "DCHP": 'O=C(c1ccccc1C(=O)OC1CCCCC1)OC1CCCCC1' "DCM": 'ClCCl' "DCME": 'COC(Cl)Cl' "DCN": 'N#Cc1ccc(c2c1cccc2)C#N' "DCPE": 'C1CCC(CC1)P(C1CCCCC1)CCP(C1CCCCC1)C1CCCCC1' "DCPG": 'NC(c1ccc(c(c1)C(=O)O)C(=O)O)C(=O)O' "DCPIB": 'CCCCC1(Cc2c(C1=O)c(Cl)c(c(c2)OCCCC(=O)O)Cl)C1CCCC1' "DCU": 'O=C(NC1CCCCC1)NC1CCCCC1' "DCX": 'CCCCCCCCCCP(=O)(C)C' "DDAB": 'CCCCCCCCCC[N+](CCCCCCCCCC)(C)C.[Br-]' "DDD": 'ClC(C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)Cl' "DDE": 'ClC(=C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)Cl' "DDED": 'COC(=O)C(=C(C#N)C#N)C(=O)OC' "DDQ": 'N#CC1=C(C#N)C(=O)C(=C(C1=O)Cl)Cl' "DDT": 'ClC(C(c1ccc(cc1)Cl)c1ccc(cc1)Cl)(Cl)Cl' "DE-71": 'Brc1ccc(c(c1)Br)Oc1cc(Br)c(cc1Br)Br' "DEA": 'CCN(c1ccccc1)CC' "DEAC": 'CC[Al+]CC.[Cl-]' "DEAD": 'CCOC(=O)/N=N/C(=O)OCC' "DEAD-H2": 'CCOC(=O)N(C(=O)OCC)N' "DEAE": 'OCCN(CC)CC' "DEEM": 'CCOC=C(C(=O)OCC)C(=O)OCC' "DEG": 'OCCOCCO' "DEHA": 'CCCCC(COC(=O)CCCCC(=O)OCC(CCCC)CC)CC' "DEHP": 'CCCCC(COC(=O)c1ccccc1C(=O)OCC(CCCC)CC)CC' "DEN": 'CCN(N=O)CC' "DEOM": 'CCOC(=O)C(=O)C(=O)OCC' "DEPC": 'CCOP(=O)(C#N)OCC' "DES": 'CCC(=C(c1ccc(cc1)O)CC)c1ccc(cc1)O' "DET": 'CCOC(=O)C(C(C(=O)OCC)O)O' "DETA": 'NCCNCCN' "DEXA": 'CCN(C(=O)c1ccc(cc1C)C)CC' "DEtA": 'CCN(C(=O)c1cccc(c1)C)CC' "DFDA": 'COC(N(C)C)OC' "DFZ": 'OCCNc1ncnc2c1c(c1ccccc1)c([nH]2)c1ccccc1' "DGL": 'OC(=O)CCC(C(=O)O)N' "DHA": 'OC1CC(O)(OC(C1O)C(=O)O)C(=O)O' "DHAP": 'CC(=O)C(OP(=O)(O)O)O' "DHBA": 'OC(=O)c1cccc(c1O)O' "DHCEO": 'CC(CCCC(C1CCC2C1(C)CCC1C2=CC(=O)C2(C1(C)CCC(C2)O)O)C)C' "DHEA": 'OC1CCC2(C(=CCC3C2CCC2(C3CCC2=O)C)C1)C' "DHEA-S": 'O=C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OS(=O)(=O)O' "DHEAS": 'O=C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OS(=O)(=O)O' "DHMEQ": 'O=C1C=C(NC(=O)c2ccccc2O)C(C2C1O2)O' "DHP": 'O1CCC=CC1' "DHPM": 'CCOC(=O)C1=C(C)NC(=O)NC1c1ccccc1' "DHPPA": 'OC(=O)C(=O)Cc1ccc(c(c1)O)O' "DHT": 'O=C1CCC2(C(C1)CCC1C2CCC2(C1CCC2O)C)C' "DIAD": 'CC(OC(=O)/N=N/C(=O)OC(C)C)C' "DIB": 'CC(=O)Oc1c(cccc1I)OC(=O)C' "DIBAH": 'CC(C[Al+]CC(C)C)C.[H-]' "DIBAL": 'CC(C[Al+]CC(C)C)C.[H-]' "DIBAL-H": 'CC(C[Al+]CC(C)C)C.[H-]' "DIBAPyr": 'CC(C[Al](n1cccc1)CC(C)C)C' "DIC": 'CC(N=C=NC(C)C)C' "DICI": 'CC(N=C=NC(C)C)C' "DICO": 'COc1ccc2c3c1OC1C43CCN(C(C2)C4CCC1=O)C' "DIEA": 'CCN(C(C)C)C(C)C' "DIM": 'c1ccc2c(c1)c(c[nH]2)Cc1c[nH]c2c1cccc2' "DINCH": 'CC(CCCCCCOC(=O)C1CCCCC1C(=O)OCCCCCCC(C)C)C' "DIOZ": 'CC(C1NC(=O)OC1(c1ccccc1)c1ccccc1)C' "DIPA": 'CC(NC(C)C)C' "DIPAM": 'Br[Mg]N(C(C)C)C(C)C' "DIPAT": '[O-]C(=O)C(F)(F)F.CC(O[Al+]OC(C)C)C' "DIPCDI": 'CC(N=C=NC(C)C)C' "DIPEA": 'CCN(C(C)C)C(C)C' "DIPT": 'OC(C(C(=O)OC(C)C)O)C(=O)OC(C)C' "DIPs": 'CC(OS(=O)(=O)OC(C)C)C' "DL--Lipoic Acid": 'OC(=O)CCCCC1SSCC1' "DL-Dithiothreitol": 'OC[C@H]([C@@H](CS)S)O' "DL-Lactic Acid": 'OC(=O)C(O)C' "DL-Malic Acid": 'OC(=O)CC(C(=O)O)O' "DLP": 'CCCCCCCCCCCC(=O)OOC(=O)CCCCCCCCCCC' "DLPC": 'CCCCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCCCCC)COP(=O)(OCC[N+](C)(C)C)[O-]' "DMA": 'CC(=O)N(C)C' "DMAD": 'COC(=O)C#CC(=O)OC' "DMAE": 'OCCN(C)C' "DMAEMA": 'CN(CCOC(=O)C(=C)C)C' "DMAG": 'COC1CC(C)CC2=C(NCCN(C)C)C(=O)C=C(C2=O)NC(=O)C(=CC=CC(C(C(=CC(C1O)C)C)OC(=O)N)OC)C' "DMAP": 'CN(c1ccncc1)C' "DMAPMA": 'CN(CCCNC(=O)C(=C)C)C' "DMAc": 'CC(=O)N(C)C' "DMAs": 'COC(=O)CC(C(=O)OC)C(=O)C' "DMAz": 'CN(CCN=[N+]=[N-])C' "DMBA": 'Cc1c2ccc3c(c2c(c2c1cccc2)C)cccc3' "DMBD": 'CC(=C)C(=C)C' "DMD": 'CC1(C)OO1' "DMDO": 'CC1(C)OO1' "DME": 'COC(OC)C' "DMEDA": 'CNCCNC' "DMEU": 'CN1CCN(C1=O)C' "DMF": 'O=CN(C)C' "DMF-DMA": 'COC(N(C)C)OC' "DMFDMA": 'COC(N(C)C)OC' "DMG": 'CN(CC(=O)O)C' "DMH1": 'CC(Oc1ccc(cc1)c1cnc2n(c1)ncc2c1ccnc2c1cccc2)C' "DMI": 'CN1CCN(C1=O)C' "DMM": 'O=[C]/C(=C(\[C]=O)/C)/C' "DMMP": 'COP(=O)(OC)C' "DMN": 'COc1cccc2c1cccc2OC' "DMOG": 'COC(=O)CNC(=O)C(=O)OC' "DMP": 'CC(=O)O[I]1(OC(=O)C)(OC(=O)C)OC(=O)c2c1cccc2' "DMPC": 'COC(=O)OC(=O)OC' "DMPEA": 'CC(c1ccccc1)N(C)C' "DMPU": 'O=C1N(C)CCCN1C' "DMS": 'CSC' "DMSO2": 'CS(=O)(=O)C' "DMT": 'COC1CCC(O1)OC' "DMTSF": 'F[B-](F)(F)F.CS[S+](C)C' "DNB": '[O-][N+](=O)c1cccc(c1)[N+](=O)[O-]' "DNBF": '[O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1)[n+]([O-])on2' "DNBS": 'CCCCOC(=O)CCC(=O)OCCCC' "DNCB": '[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])Cl' "DNFB": '[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])F' "DNJ": 'OCC1NCC(C(C1O)O)O' "DNP": '[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])O' "DNPBA": 'OOC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]' "DNPH": 'NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]' "DNQX": '[O-][N+](=O)c1cc2[nH]c(=O)c(=O)[nH]c2cc1[N+](=O)[O-]' "DNR": 'NC(=O)CC(C(=O)NC(C(=O)O)CCCN=C(N)N)NC(=O)C(CC(=O)O)N' "DOC": 'OCC(=O)C1CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C' "DOCA": 'CC(=O)OCC(=O)C1CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C' "DOI": 'COc1cc(I)c(cc1CC(N)C)OC' "DOM": 'COc1cc(C)c(cc1CC(N)C)OC' "DOPAC": 'OC(=O)Cc1ccc(c(c1)O)O' "DOPO": 'CCCCCCCCP(=O)CCCCCCCC' "DOTA": 'OC(=O)CN1CCN(CCN(CCN(CC1)CC(=O)O)CC(=O)O)CC(=O)O' "DOXIL": 'OCC(=O)C1(O)CC(OC2CC(N)C(C(O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC' "DPA": 'CC(c1ccccc1)N(C)C' "DPC": 'O=C(ON1C(=O)c2c(C1=O)cccc2)ON1C(=O)c2c(C1=O)cccc2' "DPCPX": 'CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1' "DPEP": 'CCC1=C(C)C2=Cc3[nH]c(c(c3C)CC)C=c3[nH]c(=CC4=NC5=C(C1=N2)CCC5=C4C)c(c3C)CC' "DPI": 'c1ccc2-c3c([I+]c2c1)cccc3.[Cl-]' "DPPA": 'O=P(c1ccccc1)(c1ccccc1)N=[N+]=[N-]' "DPPBz": '[O-]C(=O)c1ccccc1P(c1ccccc1)c1ccccc1' "DPPC": 'CCCCCCCCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCCCCCCCCC)COP(=O)(OCC[N+](C)(C)C)[O-]' "DPPIO": 'CC(C1COC(=N1)c1ccccc1P(c1ccccc1)c1ccccc1)C' "DPPOx": 'O=c1occn1P(=O)(Oc1ccccc1)Oc1ccccc1' "DPS": 'O=S(=O)(c1ccccc1)c1ccccc1' "DPTA": 'OC(=O)C(C(C(=O)O)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C' "DPTC": 'S=C(Oc1ccccn1)Oc1ccccn1' "DS": 'CCCCCCCCCCCCOS(=O)(=O)[O-]' "DSC": 'O=C(ON1C(=O)CCC1=O)ON1C(=O)CCC1=O' "DSPC": 'CCCCCCCCCCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(OCC[N+](C)(C)C)[O-]' "DTAB": 'CCCCCCCCCCCC[N+](C)(C)C.[Br-]' "DTBMP": 'Cc1cc(nc(c1)C(C)(C)C)C(C)(C)C' "DTBP": 'CC(c1cccc(n1)C(C)(C)C)(C)C' "DTBPB": 'CCC(OOC(C)(C)C)(OOC(C)(C)C)C' "DTBPI": 'CC(c1cccc([nH+]1)C(C)(C)C)(C)C.[I-]' "DTE": 'SCC(C(CS)O)O' "DTG": 'NC(=Nc1ccccc1C)Nc1ccccc1C' "DTMAB": 'CCCCCCCCCCCC[N+](C)(C)C.[Br-]' "DTPA": 'OC(=O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O' "DTX": 'OC1CCC2(C(C1)CCC1C2CCC2(C1(O)CCC2C1=CC(=O)OC1)C)C' "DTZ": '[Zn+2].[SH-].[SH-]' "DUDP": 'OC1CC(OC1COP(=O)(OP(=O)(O)O)O)n1ccc(=O)[nH]c1=O' "DUN": 'OC1CC(OC1COP(=O)(NP(=O)(O)O)O)n1ccc(=O)[nH]c1=O' "DXM": 'OCC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)F' "DXR": 'Brc1cccc(c1)Cc1nn(c2c1c(N)ncn2)C(C)(C)C' "DZN": 'OCC1OC(Oc2ccc3c(c2)occ(c3=O)c2ccc(cc2)O)C(C(C1O)O)O' "DZP": 'Clc1ccc2c(c1)C(=NCC(=O)N2C)c1ccccc1' "Dabigatran": 'OC(=O)CCN(C(=O)c1ccc2c(c1)nc(n2C)CNc1ccc(cc1)C(=N)N)c1ccccn1' "Dabrafenib": 'Nc1nccc(n1)c1sc(nc1c1cccc(c1F)NS(=O)(=O)c1c(F)cccc1F)C(C)(C)C' "Daidzein": 'Oc1ccc(cc1)c1coc2c(c1=O)ccc(c2)O' "Dammarane": 'CC(CCCC(C1CCC2(C1CCC1C2(C)CCC2C1(C)CCCC2(C)C)C)C)C' "Danazol": 'C#CC1(O)CCC2C1(C)CCC1C2CCC2=Cc3c(CC12C)cno3' "Danofloxacin": 'CN1CC2CC1CN2c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)O' "Darapladib": 'CCN(CCN(C(=O)Cn1c(SCc2ccc(cc2)F)nc(=O)c2c1CCC2)Cc1ccc(cc1)c1ccc(cc1)C(F)(F)F)CC' "Dasatinib": 'OCCN1CCN(CC1)c1cc(nc(n1)C)Nc1ncc(s1)C(=O)Nc1c(C)cccc1Cl' "Daunomycin": 'COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)C(OC1CC(N)C(C(O1)C)O)CC(C2)(O)C(=O)C' "Decamethylcyclopentasiloxane": 'C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](O1)(C)C)(C)C' "Decamethyltetrasiloxane": 'C[Si](O[Si](C)(C)C)(O[Si](O[Si](C)(C)C)(C)C)C' "Decursin": 'O=C(C=C(C)C)OC1Cc2cc3ccc(=O)oc3cc2OC1(C)C' "Decyltriethoxysilane": 'CCCCCCCCCC[Si](OCC)(OCC)OCC' "Decyltrimethoxysilane": 'CCCCCCCCCC[Si](OC)(OC)OC' "Decyltrimethylammonium Bromide": 'CCCCCCCCCC[N+](C)(C)C.[Br-]' "Decyltrimethylammonium Chloride": 'CCCCCCCCCC[N+](C)(C)C.[Cl-]' "Deflazacort": 'CC(=O)OCC(=O)C12N=C(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)C' "Dehydroacetic Acid": 'CC1=CC(=O)C(C(=O)O1)C(=O)C' "Dehydroepiandrosterone": 'OC1CCC2(C(=CCC3C2CCC2(C3CCC2=O)C)C1)C' "Deoxynivalenol": 'OCC12C(C=C(C(=O)C1O)C)OC1C3(C2(C)CC1O)CO3' "Desloratadine": 'Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1' "Dess-Martin Periodinane": 'CC(=O)O[I]1(OC(=O)C)(OC(=O)C)OC(=O)c2c1cccc2' "Dexamethasone": 'OCC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)F' "Dexmedetomidine": 'Cc1cccc(c1C)C(c1cnc[nH]1)C' "Dha": 'OC1CC(O)(OC(C1O)C(=O)O)C(=O)O' "Di(N-succinimidyl) Carbonate": 'O=C(ON1C(=O)CCC1=O)ON1C(=O)CCC1=O' "Di-1-adamantylphosphine": 'C1C2CC3CC1CC(C2)(C3)PC12CC3CC(C2)CC(C1)C3' "Di-2-pyridyl Carbonate": 'O=C(Oc1ccccn1)Oc1ccccn1' "Di-n-octyltin Oxide": 'CCCCCCCC[Sn](=O)CCCCCCCC' "Di-sec-butylmagnesium - Lithium Chloride": 'CCC([Mg]C(CC)C)C.[Li+].[Cl-]' "Di-tert-Butylsilane": 'CC([SiH2]C(C)(C)C)(C)C' "Di-tert-butyl 1,4-Dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate": 'O=C(C1=C(C)NC(=C(C1)C(=O)OC(C)(C)C)C)OC(C)(C)C' "Di-tert-butyl Peroxide": 'CC(OOC(C)(C)C)(C)C' "Di-tert-butylL-(+)-Tartrate": 'O[C@H]([C@H](C(=O)OC(C)(C)C)O)C(=O)OC(C)(C)C' "Di-tert-butylchlorophosphine": 'ClP(C(C)(C)C)C(C)(C)C' "Di-tert-butylmethylphosphonium Tetraphenylborate": 'c1ccc(cc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1.CC([PH+](C(C)(C)C)C)(C)C' "Di-tert-butylphenylphosphine": 'CC(P(C(C)(C)C)c1ccccc1)(C)C' "DiBP": 'CC(COC(=O)c1ccccc1C(=O)OCC(C)C)C' "Diacetoxydimethylsilane": 'CC(=O)O[Si](OC(=O)C)(C)C' "Diallyldimethylammonium Chloride": 'C=CC[N+](CC=C)(C)C.[Cl-]' "Diallyldimethylsilane": 'C=CC[Si](CC=C)(C)C' "Diazepam": 'Clc1ccc2c(c1)C(=NCC(=O)N2C)c1ccccc1' "Diazinon": 'CCOP(=S)(Oc1cc(C)nc(n1)C(C)C)OCC' "Diazoxide": 'Clc1ccc2c(c1)S(=O)(=O)N=C(N2)C' "Dibenzo[a,e]cyclooctene": 'c1ccc2c(c1)C=Cc1c(C=C2)cccc1' "DibenzylL-Tartrate": 'O[C@H]([C@H](C(=O)OCc1ccccc1)O)C(=O)OCc1ccccc1' "Dibromoisocyanuric Acid": 'O=c1n(Br)c(=O)[nH]c(=O)n1Br' "Dibutyltin Bis(trifluoromethanesulfonate)": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.CCCC[Sn+2]CCCC' "Dibutyltin Diacetate": '[O-]C(=O)C.[O-]C(=O)C.CCCC[Sn+2]CCCC' "Dibutyltin Dichloride": 'CCCC[Sn](CCCC)(Cl)Cl' "Dibutyltin Dilaurate": 'CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCC[Sn+2]CCCC' "Dibutyltin Oxide": 'CCCC[Sn](=O)CCCC' "Dichloramine B": 'ClN(S(=O)(=O)c1ccccc1)Cl' "Dichloramine T": 'ClN(S(=O)(=O)c1ccc(cc1)C)Cl' "Dichloro(1,10-phenanthroline)copper(II)": 'c1ccc2c(n1)c1ncccc1cc2.Cl[Cu]Cl' "Dichloro(N,N,N',N'-tetramethylethylenediamine)zinc(II)": 'CN(CCN(C)C)C.Cl[Zn]Cl' "Dichloro(diethylamino)phosphine": 'CCN(P(Cl)Cl)CC' "Dichloro(methyl)(3,3,3-trifluoropropyl)silane": 'FC(CC[Si](Cl)(Cl)C)(F)F' "Dichloro(methyl)-n-octylsilane": 'CCCCCCCC[Si](Cl)(Cl)C' "Dichloro(p-cymene)ruthenium(II)": 'Cc1ccc(cc1)C(C)C.Cl[Ru]Cl' "Dichloro[9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene]palladium(II)": 'CC1(C)c2cccc(c2Oc2c1cccc2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.Cl[Pd]Cl' "Dichloroacetic Acid": 'ClC(C(=O)O)Cl' "Dichlorocyclohexylmethylsilane": 'C[Si](C1CCCCC1)(Cl)Cl' "Dichlorodecylmethylsilane": 'CCCCCCCCCC[Si](Cl)(Cl)C' "Dichlorododecylmethylsilane": 'CCCCCCCCCCCC[Si](Cl)(Cl)C' "Dichlorohexylmethylsilane": 'CCCCCC[Si](Cl)(Cl)C' "Dichloromethylvinylsilane": 'C=C[Si](Cl)(Cl)C' "Dichlorophenylphosphine": 'ClP(c1ccccc1)Cl' "Dichlorotitanium Diisopropoxide": '[O-]C(C)C.[O-]C(C)C.Cl[Ti+2]Cl' "Diclectin": 'OC(=O)CCC(=O)O.CN(CCOC(c1ccccn1)(c1ccccc1)C)C.OCc1c(CO)cnc(c1O)C.Cl' "Diclofenac": 'OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl' "Dicobalt Octacarbonyl (stabilized with 1-5% Hexane)": '[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH-]=O.[CH-]=O.[Co].[Co+2]' "Dicofol": 'OC(C(Cl)(Cl)Cl)(c1ccc(cc1)Cl)c1ccc(cc1)Cl' "Dicyclohexyl(2,4,6-triisopropylphenyl)phosphine": 'CC(c1cc(cc(c1P(C1CCCCC1)C1CCCCC1)C(C)C)C(C)C)C' "Dicyclohexyl(trifluoromethanesulfonyloxy)borane": 'FC(S(=O)(=O)OB(C1CCCCC1)C1CCCCC1)(F)F' "Dicyclohexylamine Borane": 'C1CCC(CC1)NC1CCCCC1.B' "Dicyclohexylphenylphosphine": 'C1CCC(CC1)P(c1ccccc1)C1CCCCC1' "Dicyclopentadiene": 'C1=CC2C(C1)C1C=CC2C1' "Dicyclopentadiene (stabilized with BHT) [precursor to Cyclopentadiene]": 'C1=CC2C(C1)C1C=CC2C1' "Dicyclopentyl(dimethoxy)silane": 'CO[Si](C1CCCC1)(C1CCCC1)OC' "Didecyldimethylammonium Bromide": 'CCCCCCCCCC[N+](CCCCCCCCCC)(C)C.[Br-]' "Didodecyldimethylammonium Chloride": 'CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(C)C.[Cl-]' "Diethoxy(methyl)phenylsilane": 'CCO[Si](c1ccccc1)(OCC)C' "Diethoxydimethylsilane": 'CCO[Si](OCC)(C)C' "Diethoxydiphenylsilane": 'CCO[Si](c1ccccc1)(c1ccccc1)OCC' "Diethoxymethylsilane": 'CCO[SiH](OCC)C' "Diethoxymethylvinylsilane": 'CCO[Si](OCC)(C=C)C' "Diethyl (Bromodifluoromethyl)phosphonate": 'CCOP(=O)(C(Br)(F)F)OCC' "Diethyl 1,4-Dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate": 'CCOC(=O)C1=C(C)NC(=C(C1)C(=O)OCC)C' "Diethyl Cyanophosphonate": 'CCOP(=O)(C#N)OCC' "Diethyl(2-methoxyethyl)methylammonium Bis(fluorosulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.COCC[N+](CC)(CC)C' "Diethyl(isopropyl)silanol": 'CC[Si](C(C)C)(CC)O' "DiethylD-(-)-Tartrate": 'CCOC(=O)[C@H]([C@@H](C(=O)OCC)O)O' "DiethylL-(+)-Tartrate": 'CCOC(=O)[C@@H]([C@H](C(=O)OCC)O)O' "Diethylenetriamine": 'NCCNCCN' "Diethylphenylphosphine": 'CCP(c1ccccc1)CC' "Difluoroacetic Acid": 'FC(C(=O)O)F' "Difluoroacetic Anhydride": 'FC(C(=O)OC(=O)C(F)F)F' "Difluoromethyl 2-Pyridyl Sulfone": 'FC(S(=O)(=O)c1ccccn1)F' "Difluoromethyl Phenyl Sulfide": 'FC(Sc1ccccc1)F' "Difluoromethyl Phenyl Sulfone": 'FC(S(=O)(=O)c1ccccc1)F' "Digitoxigenin": 'OC1CCC2(C(C1)CCC1C2CCC2(C1(O)CCC2C1=CC(=O)OC1)C)C' "Diglyme": 'COCCOCCOC' "Digoxin": 'O=C1OCC(=C1)C1CCC2(C1(C)C(O)CC1C2CCC2C1(C)CCC(C2)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)O)O' "Diisobutyldimethoxysilane": 'CO[Si](CC(C)C)(CC(C)C)OC' "DiisopropylD-(-)-Tartrate": 'O[C@@H]([C@@H](C(=O)OC(C)C)O)C(=O)OC(C)C' "DiisopropylL-(+)-Tartrate": 'O[C@H]([C@H](C(=O)OC(C)C)O)C(=O)OC(C)C' "Dilauryldimethylammonium Bromide": 'CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(C)C.[Br-]' "Dilithium Tetrachlorocopper(II)": 'Cl[Cu-](Cl)(Cl)Cl.Cl[Cu-](Cl)(Cl)Cl.[Li+].[Li+]' "Dimesitylammonium Pentafluorobenzenesulfonate": 'Fc1c(F)c(F)c(c(c1F)S(=O)(=O)[O-])F.Cc1cc(C)cc(c1[NH2+]c1c(C)cc(cc1C)C)C' "Dimethoxy(methyl)(3,3,3-trifluoropropyl)silane": 'CO[Si](CCC(F)(F)F)(OC)C' "Dimethoxy(methyl)silane": 'CO[SiH](OC)C' "Dimethoxydi-p-tolylsilane": 'CO[Si](c1ccc(cc1)C)(c1ccc(cc1)C)OC' "Dimethoxydimethylsilane": 'CO[Si](OC)(C)C' "Dimethoxydiphenylsilane": 'CO[Si](c1ccccc1)(c1ccccc1)OC' "Dimethoxymethylvinylsilane": 'CO[Si](C=C)(OC)C' "Dimethyl 2,2'-Bipyridine-4,4'-dicarboxylate": 'COC(=O)c1ccnc(c1)c1nccc(c1)C(=O)OC' "Dimethyl 2,2'-Bipyridine-6,6'-dicarboxylate": 'COC(=O)c1cccc(n1)c1cccc(n1)C(=O)OC' "Dimethyl Sulfide Borane": 'CSC.B' "DimethylD-(-)-Tartrate": 'COC(=O)[C@H]([C@@H](C(=O)OC)O)O' "DimethylL-(+)-Tartrate": 'COC(=O)[C@@H]([C@H](C(=O)OC)O)O' "Dimethylamine": 'CNC' "Dimethylamine Borane": 'CNC.B' "Dimethylbis(phenylethynyl)silane": 'C[Si](C#Cc1ccccc1)(C#Cc1ccccc1)C' "Dimethyldimyristylammonium Bromide": 'CCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCC)(C)C.[Br-]' "Dimethyldioctadecylammonium Bromide": 'CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(C)C.[Br-]' "Dimethyldioctadecylammonium Iodide": 'CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(C)C.[I-]' "Dimethyldioctylammonium Bromide": 'CCCCCCCC[N+](CCCCCCCC)(C)C.[Br-]' "Dimethyldipalmitylammonium Bromide": 'CCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCC)(C)C.[Br-]' "Dimethyldiphenylsilane": 'C[Si](c1ccccc1)(c1ccccc1)C' "Dimethyldivinylsilane": 'C=C[Si](C=C)(C)C' "Dimethylphenylphosphine Borane": 'CP(c1ccccc1)C.B' "Dimethylphenylsilane": 'C[SiH](c1ccccc1)C' "Dimethylthiophosphinoyl Chloride": 'CP(=S)(Cl)C' "Dimethyltin Dichloride": 'C[Sn](Cl)(Cl)C' "Dimethyltin Oxide": 'C[Sn](=O)C' "Dimethyltitanocene": '[CH]1C=CC=C1.[CH]1C=CC=C1.C[Ti]C' "Dioscin": 'OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C3(O4)CCC(CO3)C)C)C2)C)C(C(C1OC1OC(C)C(C(C1O)O)O)O)OC1OC(C)C(C(C1O)O)O' "Diosmetin": 'COc1ccc(cc1O)c1cc(=O)c2c(o1)cc(cc2O)O' "Diosmin": 'COc1ccc(cc1O)c1cc(=O)c2c(o1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "Diphenyl-2-pyridylphosphine": 'c1ccc(cc1)P(c1ccccn1)c1ccccc1' "Diphenylammonium Trifluoromethanesulfonate": 'c1ccc(cc1)[NH2+]c1ccccc1.FC(S(=O)(=O)[O-])(F)F' "Diphenylbis(phenylethynyl)silane": 'c1ccc(cc1)[Si](c1ccccc1)(C#Cc1ccccc1)C#Cc1ccccc1' "Diphenyldichlorogermane": 'Cl[Ge](c1ccccc1)(c1ccccc1)Cl' "Diphenylphosphine Oxide": 'O=P(c1ccccc1)c1ccccc1' "Diphenylphosphinic Chloride": 'ClP(=O)(c1ccccc1)c1ccccc1' "Diphenylphosphoryl Azide": 'O=P(c1ccccc1)(c1ccccc1)N=[N+]=[N-]' "Diphenylpropylphosphine": 'CCCP(c1ccccc1)c1ccccc1' "Diphenylsilane": 'c1ccc(cc1)[SiH2]c1ccccc1' "Diphenylsilanediol": 'O[Si](c1ccccc1)(c1ccccc1)O' "Diphosphoryl Chloride": 'OP(=O)(OP(=O)(Cl)O)O' "Dipivaloylmethane": 'O=C(C(C)(C)C)CC(=O)C(C)(C)C' "Dipotassium (R)-1,1'-Binaphthyl-2,2'-disulfonate": '[O-]S(=O)(=O)c1ccc2c(c1c1c3ccccc3ccc1S(=O)(=O)[O-])cccc2.[K+].[K+]' "Dmb": 'COc1cc([CH2])ccc1OC' "Dmips": 'C[Si](C(C)C)C' "DnBP": 'CCC(c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-])C' "Dodecamethylcyclohexasiloxane": 'C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C' "Dodecamethylpentasiloxane": 'C[Si](O[Si](O[Si](C)(C)C)(C)C)(O[Si](O[Si](C)(C)C)(C)C)C' "Dodecyltriethoxysilane": 'CCCCCCCCCCCC[Si](OCC)(OCC)OCC' "Dodecyltrimethoxysilane": 'CCCCCCCCCCCC[Si](OC)(OC)OC' "Dodecyltrimethylammonium Bromide": 'CCCCCCCCCCCC[N+](C)(C)C.[Br-]' "Dodecyltrimethylammonium Chloride": 'CCCCCCCCCCCC[N+](C)(C)C.[Cl-]' "Dolutegravir": 'Fc1ccc(c(c1)F)CNC(=O)c1cn2CC3OCCC(N3C(=O)c2c(c1=O)O)C' "DomA": 'OC(=O)C(c1ccc(c(c1)O)O)O' "Donepezil": 'COc1cc2c(cc1OC)CC(C2=O)CC1CCN(CC1)Cc1ccccc1' "Dopamine": 'NCCc1ccc(c(c1)O)O' "Doxorubicin": 'OCC(=O)C1(O)CC(OC2CC(N)C(C(O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC' "Dpm": 'c1ccc(cc1)[CH]c1ccccc1' "Dronedarone": 'CCCCc1oc2c(c1C(=O)c1ccc(cc1)OCCCN(CCCC)CCCC)cc(cc2)NS(=O)(=O)C' "DuPhos": 'o1[pH]c2c([pH]1)ccc1c2[pH]o[pH]1' "Duloxetine": 'CNCCC(c1cccs1)Oc1cccc2c1cccc2' "Duroquinone": 'CC1=C(C)C(=O)C(=C(C1=O)C)C' "E-64d": 'CCOC(=O)C1OC1C(=O)NC(C(=O)NCCC(C)C)CC(C)C' "E-stilbene": 'c1ccc(cc1)C=Cc1ccccc1' "EACNOx": 'CCOC(=O)/C(=N/O)/C#N' "EAN": '[O-][N+](=O)[O-].CC[NH3+]' "EBNA": 'CCN(C(C)(C)C)N=O' "ECG": 'Oc1cc(O)c2c(c1)OC(C(C2)OC(=O)c1cc(O)c(c(c1)O)O)c1ccc(c(c1)O)O' "ECH": 'ClCC1CO1' "EDA": '[N-]=[N+]=CC(=O)OCC' "EDC": 'CCN=C=NCCCN(C)C' "EDCI": 'CCN=C=NCCCN(C)C' "EDDA": 'OC(=O)CNCCNCC(=O)O' "EDP": 'CCOC(=O)C(=O)C=[N+]=[N-]' "EDS": 'CS(=O)(=O)OCCOS(=O)(=O)C' "EDTA": 'OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O' "EE2": 'C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O' "EEDQ": 'CCOC(=O)N1C(OCC)C=Cc2c1cccc2' "EFV": 'FC(C1(C#CC2CC2)OC(=O)Nc2c1cc(Cl)cc2)(F)F' "EGC": 'Oc1cc2OC(c3cc(O)c(c(c3)O)O)C(Cc2c(c1)O)O' "EGCG": 'Oc1cc(O)c2c(c1)OC(C(C2)OC(=O)c1cc(O)c(c(c1)O)O)c1cc(O)c(c(c1)O)O' "EGDE": '[O-][N+](=O)OCCO[N+](=O)[O-]' "EGDMA": 'O=C(C(=C)C)OCCOC(=O)C(=C)C' "EGTA": 'OC(=O)CN(CC(=O)O)CCOCCOCCN(CC(=O)O)CC(=O)O' "ELD": 'CCCCCCCCC=CCCCCCCCC(=O)N' "EMPA": 'COc1ccc(cn1)N(S(=O)(=O)c1ccccc1C)CC(=O)N(Cc1cccnc1)CC' "EMS": 'CCOS(=O)(=O)C' "ENR": 'NC(=O)CC(C(=O)NC(C(=O)O)CCCN=C(N)N)NC(=O)C(CCC(=O)O)N' "EPA": 'CCC=CCC=CCC=CCC=CCC=CCCCC(=O)O' "EPHP": 'CCN1CCCCC1.OP=O' "ETBE": 'CCOC(C)(C)C' "ETPB": 'CCC12COP(OC1)OC2' "ETU": 'S=C1NCCN1' "EVOH": 'OC=C.C=C' "EZETIMIBE": 'Oc1ccc(cc1)C1C(CCC(c2ccc(cc2)F)O)C(=O)N1c1ccc(cc1)F' "Ebselen": 'O=c1c2ccccc2[se]n1c1ccccc1' "Ecstasy": 'CNC(Cc1ccc2c(c1)OCO2)C' "Ectoine": 'OC(=O)C1CCN=C(N1)C' "Efavirenz": 'FC(C1(C#CC2CC2)OC(=O)Nc2c1cc(Cl)cc2)(F)F' "Elacridar": 'COc1cc2CN(CCc3ccc(cc3)NC(=O)c3cccc4c3[nH]c3c(OC)cccc3c4=O)CCc2cc1OC' "Eldecalcitol": 'OCCCOC1C(O)CC(=CC=C2CCCC3(C2CCC3C(CCCC(O)(C)C)C)C)C(=C)C1O' "Elisidepsin": 'NCCCC(C(=O)NC(C(=O)NC1C(C)OC(=O)C(NC(=O)C(=CC)NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)C(CC)C)C(C)C)Cc1ccccc1)C(C)C)C(CC)C)NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)C(C(O)C)NC(=O)C(C(C)C)NC(=O)CCC(CC)C' "Embelin": 'CCCCCCCCCCCC1=C(O)C(=O)C=C(C1=O)O' "Emodin": 'Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O' "Emodinol": 'Cc1cc2Cc3cc(O)cc(c3C(=O)c2c(c1)O)O' "Emtricitabine": 'Nc1nc(=O)n(cc1F)C1CSC(O1)CO' "Endomorphin-1": 'Oc1ccc(cc1)CC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)N)Cc1ccccc1)Cc1c[nH]c2c1cccc2)N' "Endosulfan": 'O=S1OCC2C(CO1)C1(C(C2(Cl)C(=C1Cl)Cl)(Cl)Cl)Cl' "Enmein": 'OC1OCC23C1C(C)(C)C(CC2OC(=O)C12C3CCC(C1)C(=C)C2=O)O' "Entecavir": 'OCC1C(O)CC(C1=C)n1cnc2c1[nH]c(N)nc2=O' "Enzalutamide": 'CNC(=O)c1ccc(cc1F)N1C(=S)N(C(=O)C1(C)C)c1ccc(c(c1)C(F)(F)F)C#N' "Epichlorohydrin": 'ClCC1CO1' "Epigallocatechin-3-gallate": 'Oc1cc(O)c2c(c1)OC(C(C2)OC(=O)c1cc(O)c(c(c1)O)O)c1cc(O)c(c(c1)O)O' "Erlotinib": 'COCCOc1cc2c(ncnc2cc1OCCOC)Nc1cccc(c1)C#C' "Escitalopram": 'N#Cc1ccc2c(c1)COC2(CCCN(C)C)c1ccc(cc1)F' "Estradiol": 'Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2O)C' "Et2AlBr": 'CC[Al](CC)Br' "Et2AlCl": 'CC[Al](CC)Cl' "Et2AlI": 'CC[Al](CC)I' "Et2NSF3": 'CCN(S(F)(F)F)CC' "Et2O": 'CCOCC' "Et3N": 'CCN(CC)CC' "EtAc": 'CCN(c1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)cc(c(c1)C)Nc1ccccc1)c1ccc(cc1)C' "EtLi": '[Li]CC' "EtMgBr": 'CC[Mg]Br' "EtMgCl": 'CC[Mg]Cl' "EtNH2": 'CCN' "EtNH2.HCl": 'CCN.Cl' "EtOAc": 'CCOC(=O)C' "EtOH": 'CCO' "EtOLi": '[O-]CC.[Li+]' "Etazolate": 'CCOC(=O)c1cnc2c(c1NN=C(C)C)cnn2CC' "Ethoxydiphenylphosphine": 'CCOP(c1ccccc1)c1ccccc1' "Ethoxytriethylsilane": 'CCO[Si](CC)(CC)CC' "Ethyl 1-Hydroxy-1H-1,2,3-triazole-4-carboxylate": 'CCOC(=O)c1cn(nn1)O' "Ethyl Chloroglyoxylate": 'CCOC(=O)C(=O)Cl' "Ethyl Cyano(hydroxyimino)acetate": 'CCOC(=O)/C(=N/O)/C#N' "Ethylamine": 'CCN' "Ethylamine Hydrochloride": 'CCN.Cl' "Ethylboronic Acid": 'CCB(O)O' "Ethyldiphenylphosphine": 'CCP(c1ccccc1)c1ccccc1' "Ethylene diamine": 'NCCN' "Ethylenediaminetetraacetic Acid": 'OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O' "Ethylenedithiobis(trimethylsilane)": 'C[Si](SCCS[Si](C)(C)C)(C)C' "Ethylmagnesium Bromide": 'CC[Mg]Br' "Ethylmagnesium Chloride": 'CC[Mg]Cl' "Ethyltrimethylammonium Iodide": 'CC[N+](C)(C)C.[I-]' "Etoposide": 'COc1cc(cc(c1O)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)OC1OC2COC(OC2C(C1O)O)C' "Eu": '[Eu]' "Eudragit": 'COC(=O)C(=C)C' "Eugenol": 'C=CCc1ccc(c(c1)OC)O' "Eunicellin": 'CC(=O)OC1CCC(C)(OC(=O)C)C2OC(CC1=C)C1C2C(CC(C1(C)OC(=O)C)OC(=O)C)C(C)C' "Europium": '[Eu]' "Everolimus": 'OCCOC1CCC(CC1OC)CC(C1OC(=O)C2CCCCN2C(=O)C(=O)C2(O)OC(CCC2C)CC(OC)C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)C1)C)C)O)OC)C)C)C)C' "Evodiamine": 'O=C1c2ccccc2N(C2N1CCc1c2[nH]c2c1cccc2)C' "Exemestane": 'O=C1C=CC2(C(=C1)C(=C)CC1C2CCC2(C1CCC2=O)C)C' "Ezetimibe": 'Oc1ccc(cc1)C1C(CCC(c2ccc(cc2)F)O)C(=O)N1c1ccc(cc1)F' "Ezogabine": 'CCOC(=O)Nc1ccc(cc1N)NCc1ccc(cc1)F' "F2": 'FF' "F4-TCNQ": 'N#CC(=c1c(F)c(F)c(=C(C#N)C#N)c(c1F)F)C#N' "FBA": 'F[B-](F)(F)F.[H+]' "FBP": 'OC1C(COP(=O)(O)O)OC(C1O)(O)COP(=O)(O)O' "FC-72": 'FC(C(C(F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F' "FC-75": 'FC(C(C(C1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F' "FCF": 'O=c1cc(C=NOCCON=Cc2cccc(c2)C(=O)O)[nH]c(=O)[nH]1' "FDNB": '[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])F' "FDPP": 'Fc1c(OP(=O)(c2ccccc2)c2ccccc2)c(F)c(c(c1F)F)F' "FDV": 'OC1CC(OC1COP(=O)(OP(=O)(C(P(=O)(O)O)C)O)O)n1cc(C)c(=O)[nH]c1=O' "FEE": 'CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(C(C(CCCCC)O)O)COC1OC(CO)C(C(C1O)O)O' "FFA": 'OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F' "FICZ": 'O=Cc1c2[nH]c3c(c2cc2c1c1ccccc1[nH]2)cccc3' "FITC": 'S=C=Nc1ccc2c(c1)C(=O)OC12c2ccc(cc2Oc2c1ccc(c2)O)O' "FLT": 'OCC1OC(CC1F)n1cc(C)c(=O)[nH]c1=O' "FLX": 'CC(CC(C(=O)NC(P(=O)(O)O)Cc1c[nH]c2c1cccc2)NC(=O)c1ccco1)C' "FMCA": 'OCC1C(O)C(C(C1=C)n1cnc2c1ncnc2N)F' "FMCAP": 'COC(=O)C(NP(=O)(Oc1ccccc1)OCC1C(O)C(C(C1=C)n1cnc2c1ncnc2N)F)C' "FMS": 'FC(c1ccc2c(c1)n(nn2)S(=O)(=O)C)(F)F' "FOLFIRI": 'Fc1c[nH]c(=O)[nH]c1=O.CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(cc4c(c3Cn1c2=O)CC)OC(=O)N1CCC(CC1)N1CCCCC1.O=CN1C(CNc2ccc(cc2)C(=O)NC(C(=O)O)CCC(=O)O)CNc2c1c(=O)nc([nH]2)N' "FPI": 'O=CN1CCCCC1' "FS": 'ON(S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]' "FST": 'OCC=CC=CC=CC(CC(C(C=CC1CC=CC(=O)O1)(O)C)OP(=O)(O)[O-])O.[Na+]' "FTS": 'CC(=CCSc1ccccc1C(=O)O)CCC=C(CCC=C(C)C)C' "Fampridine": 'Nc1ccncc1' "FdU": 'OCC1OC(CC1O)n1cc(F)c(=O)[nH]c1=O' "Fe": '[Fe]' "Fe(OH)3": '[Fe+3].[OH-].[OH-].[OH-]' "Fe-NTA": '[O-]C(=O)CN(CC(=O)[O-])CC(=O)[O-].[Fe+3]' "Fe2O3": 'O=[Fe]O[Fe]=O' "Fe3O4": 'O=[Fe]O[Fe]=O.O=[Fe]' "Fe3S4": '[S-2].[S-2].[S-2].[S-2].[Fe+2].[Fe+3].[Fe+3]' "FeBr2": '[Fe+2].[Br-].[Br-]' "FeBr3": '[Fe+3].[Br-].[Br-].[Br-]' "FeCl2": '[Cl-].[Cl-].[Fe+2]' "FeCl3": '[Cl-].[Cl-].[Cl-].[Fe+3]' "FeO": '[Fe].[Fe].O' "FePO4": '[O-]P(=O)([O-])[O-].[Fe+3]' "FeSO4": '[O-]S(=O)(=O)[O-].[Fe+2]' "FeSe": '[Fe]=[Se]' "Fenamiphos": 'CCOP(=O)(Oc1ccc(c(c1)C)SC)NC(C)C' "Fenfluramine": 'CCNC(Cc1cccc(c1)C(F)(F)F)C' "Fenhexamid": 'O=C(C1(C)CCCCC1)Nc1ccc(c(c1Cl)Cl)O' "Fenofibrate": 'CC(OC(=O)C(Oc1ccc(cc1)C(=O)c1ccc(cc1)Cl)(C)C)C' "Fexofenadine": 'OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C' "Fingolimod": 'CCCCCCCCc1ccc(cc1)CCC(CO)(CO)N' "Fipronil": 'N#Cc1nn(c(c1S(=O)C(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F' "Fisetin": 'Oc1ccc2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O' "Flavanone": 'O=C1CC(Oc2c1cccc2)c1ccccc1' "Flavone": 'O=c1cc(oc2c1cccc2)c1ccccc1' "Floxuridine": 'OCC1OC(CC1O)n1cc(F)c(=O)[nH]c1=O' "Flubendazole": 'COC(=O)Nc1nc2c([nH]1)cc(cc2)C(=O)c1ccc(cc1)F' "Fludioxonil": 'N#Cc1c[nH]cc1c1cccc2c1OC(O2)(F)F' "Fluo-4": 'OC(=O)CN(c1ccc(cc1OCCOc1cc(C)ccc1N(CC(=O)O)CC(=O)O)c1c2-c(oc3c1cc(F)c(c3)O)cc(=O)c(c2)F)CC(=O)O' "Fluorene": 'c1ccc2-c3c(Cc2c1)cccc3' "Fluorescein": 'Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)ccc(c1)O' "Fluoro-N,N,N',N'-tetramethylformamidinium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN(C(=[N+](C)C)F)C' "Fluoxetine": 'CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F' "Flurbiprofen": 'OC(=O)C(c1ccc(c(c1)F)c1ccccc1)C' "Folate": 'OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(=O)nc([nH]2)N' "Folic Acid Hydrate": 'OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(=O)[nH]c(n2)N.O' "Forskolin": 'C=CC1(C)CC(=O)C2(C(O1)(C)C(OC(=O)C)C(C1C2(C)C(O)CCC1(C)C)O)O' "Forum": 'COc1cc(ccc1OC)C(=CC(=O)N1CCOCC1)c1ccc(cc1)Cl' "Foscan": 'Oc1cccc(c1)C1=C2CCC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1cccc(c1)O)C=C3)c1cccc(c1)O)[nH]2)c1cccc(c1)O' "Fosdevirine": 'N#CC=Cc1cc(C)cc(c1)P(=O)(c1c([nH]c2c1cc(Cl)cc2)C(=O)N)OC' "Fp": 'O=[C-][Fe+]C1C=CC=C1.O=[C-][Fe+]C1C=CC=C1.[C-]#[O+].[C-]#[O+]' "Friedelin": 'O=C1CCC2C(C1C)(C)CCC1C2(C)CCC2(C1(C)CCC1(C2CC(C)(C)CC1)C)C' "Fructose": 'OCC1(O)OCC(C(C1O)O)O' "Fucoxanthin": 'CC(=CC=CC=C(C=CC=C(C(=O)CC12OC2(C)CC(CC1(C)C)O)C)C)C=CC=C(C=C=C1C(C)(C)CC(CC1(C)O)OC(=O)C)C' "Fullerene": 'c12c3c4c5c2c2c6c7c1c1c8c3c3c9c4c4c%10c5c5c2c2c6c6c%11c7c1c1c7c8c3c3c8c9c4c4c9c%10c5c5c2c2c6c6c%11c1c1c7c3c3c8c4c4c9c5c2c2c6c1c3c42' "Fulvestrant": 'O=S(CCCC(C(F)(F)F)(F)F)CCCCCCCCCC1Cc2cc(O)ccc2C2C1C1CCC(C1(CC2)C)O' "Fumaric Acid": 'OC(=O)/C=C/C(=O)O' "Fura-2": 'OC(=O)CN(c1cc2oc(cc2cc1OCCOc1cc(C)ccc1N(CC(=O)O)CC(=O)O)c1ncc(o1)C(=O)O)CC(=O)O' "Furanodiene": 'CC1=CCc2c(CC(=CCC1)C)occ2C' "Furosemide": 'OC(=O)c1cc(c(cc1NCc1ccco1)Cl)S(=O)(=O)N' "Furostanol": 'OCC(CCC1OC2C(C1C)C1(C(C2)C2CCC3C(C2CC1)(C)CCCC3)C)C' "GABA": 'NCCCC(=O)O' "GAL": 'OCC1OC(O)C(C(C1O)O)O' "GBL": 'O=C1CCCO1' "GDP": 'OC1C(COP(=O)(OP(=O)(O)O)O)OC(C1O)n1cnc2c1[nH]c(N)nc2=O' "GEE": 'CCOC(=O)CN' "GEM": 'OC(=O)CC(C(=O)O)SCCN=C(N)N' "GFC": 'OC1CC(OC1COP(=O)(OP(=O)(C(P(=O)(O)O)(Cl)F)O)O)n1cnc2c1[nH]c(N)nc2=O' "GHB": 'OCCCC(=O)O' "GKB": 'O=C1OC2C(C1C)(O)C13C4(C2O)C(OC3=O)CC(C24C(O1)OC(=O)C2O)C(C)(C)C' "GLN": 'NC(=O)CCC(C(=O)O)N' "GLP": 'O=C1CC[C@H](N1)C(=O)O' "GNP": 'OC1C(COP(=O)(OP(=O)(NP(=O)(O)O)O)O)OC(C1O)n1cnc2c1[nH]c(N)nc2=O' "GPV": 'OCC1OC(C(C(C1O)O)O)n1cc(I)c(=O)[nH]c1=O' "GSH": 'SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N' "GSNO": 'O=NSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N' "GSSG": 'O=C(NC(C(=O)NCC(=O)O)CSSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)CCC(C(=O)O)N' "GSSH": 'SSCC(C(=O)NCC(=O)[O-])NC(=O)CCC(C(=O)[O-])[NH3+]' "GTN": '[O-][N+](=O)OC(CO[N+](=O)[O-])CO[N+](=O)[O-]' "GTP": 'OC1C(COP(=O)(OP(=O)(OP(=O)(O)O)O)O)OC(C1O)n1cnc2c1[nH]c(N)nc2=O' "GUT-70": 'CCCc1cc(=O)oc2c1c1OC(C)(C)C=Cc1c(c2C(=O)C(=CC)C)OC' "GaS": 'N#Cc1ccc(cc1)NC(=NCC(=O)O)NC(c1ccccc1)c1ccccc1' "Gabapentin": 'NCC1(CCCCC1)CC(=O)O' "Gal": 'OCC1OC(O)C(C(C1O)O)O' "GalA": 'OC1OC(C(=O)O)C(C(C1O)O)O' "GalNAc": 'OCC1OC(O)C(C(C1O)O)NC(=O)C' "Galactose": 'OCC1OC(O)C(C(C1O)O)O' "Galangin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccccc1' "Galantamine": 'COc1ccc2c3c1OC1C3(CCN(C2)C)C=CC(C1)O' "Galanthamine": 'COc1ccc2c3c1OC1C3(CCN(C2)C)C=CC(C1)O' "Gallein": 'O=C1OC2(c3c1cccc3)c1ccc(c(c1Oc1c2ccc(c1O)O)O)O' "Gallic Acid Hydrate": 'OC(=O)c1cc(O)c(c(c1)O)O.O' "Ganodermanondiol": 'CC(C1CCC2(C1(C)CC=C1C2=CCC2C1(C)CCC(=O)C2(C)C)C)CCC(C(O)(C)C)O' "Gaster": 'NC(=Nc1scc(n1)CSCCC(=NS(=O)(=O)N)N)N' "Gastrodin": 'OCC1OC(Oc2ccc(cc2)CO)C(C(C1O)O)O' "Gd-BOPTA": 'OC(=O)CN(C(C(=O)[O-])COCc1ccccc1)CCN(CC(=O)[O-])CCN(CC(=O)O)CC(=O)[O-].CNCC(C(C(C(CO)O)O)O)O.CNCC(C(C(C(CO)O)O)O)O.[Gd+3]' "Gd-BT-DO3A": 'OCC(C(N1CCN(CCN(CCN(CC1)CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])CO)O.[Gd+3]' "Gefitinib": 'COc1cc2ncnc(c2cc1OCCCN1CCOCC1)Nc1ccc(c(c1)Cl)F' "Gemcitabine": 'OCC1OC(C(C1O)(F)F)n1ccc(nc1=O)N' "Genipin": 'COC(=O)C1=COC(C2C1CC=C2CO)O' "Genistein": 'Oc1ccc(cc1)c1coc2c(c1=O)c(O)cc(c2)O' "Genistin": 'OCC1OC(Oc2cc(O)c3c(c2)occ(c3=O)c2ccc(cc2)O)C(C(C1O)O)O' "Gentianine": 'C=Cc1cncc2c1CCOC2=O' "Gentiopicroside": 'C=CC1C(OC=C2C1=CCOC2=O)OC1OC(CO)C(C(C1O)O)O' "Gentisin": 'COc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)O' "Geraniol": 'OCC=C(CCC=C(C)C)C' "Gimatecan": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccccc4c(c3Cn1c2=O)C=NOC(C)(C)C' "Ginkgetin": 'COc1ccc(cc1c1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O)c1cc(=O)c2c(o1)cc(cc2O)OC' "Glabridin": 'Oc1ccc(c(c1)O)C1COc2c(C1)ccc1c2C=CC(O1)(C)C' "Glaucine": 'COc1cc2-c3c(OC)c(OC)cc4c3C(Cc2cc1OC)N(C)CC4' "Glc": 'OC[C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O' "GlcA": 'OC1OC(C(=O)O)C(C(C1O)O)O' "GlcNAc": 'OCC1OC(O)C(C(C1O)O)NC(=O)C' "Gln": 'NC(=O)CC[C@@H](C(=O)O)N' "Glu": 'NC(=O)CC[C@@H](C(=O)O)N' "Glu-P-1": 'Nc1ccc2c(n1)n1cccc(c1n2)C' "Glu-P-2": 'Nc1ccc2c(n1)n1ccccc1n2' "Glucantime": 'O[Sb](=O)=O.CNCC(C(C(C(CO)O)O)O)O' "Glucosamine": 'OCC1OC(O)C(C(C1O)O)N' "Glucose": 'OCC1OC(O)C(C(C1O)O)O' "Glufosinate": 'OC(=O)C(CCP(=O)(O)C)N' "Glutamine": 'NC(=O)CCC(C(=O)O)N' "Glutaraldehyde": 'O=CCCCC=O' "Glutathione": 'SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N' "Gly": 'NCC(=O)O' "Gly-Sar": 'CN(C(=O)CN)CC(=O)O' "Glycerol": 'OCC(CO)O' "Glycine": 'NCC(=O)O' "Glycolic Acid": 'OCC(=O)O' "Glyme": 'COCCOC' "Glyoxal": 'O=CC=O' "Glyphosate": 'OC(=O)CNCP(=O)(O)O' "Gold": '[Au]' "Goniothalamin": 'O=C1C=CCC(O1)C=Cc1ccccc1' "Gossypol": 'O=Cc1c(O)c(O)c(c2c1c(O)c(c(c2)C)c1c(C)cc2c(c1O)c(C=O)c(c(c2C(C)C)O)O)C(C)C' "Graphene": '[C]' "Griseofulvin": 'COC1=CC(=O)CC(C21Oc1c(C2=O)c(OC)cc(c1Cl)OC)C' "Guanine": 'Nc1nc(=O)c2c([nH]1)nc[nH]2' "H+": '[H+]' "H+Cl-": 'Cl' "H-89": 'Brc1ccc(cc1)C=CCNCCNS(=O)(=O)c1cccc2c1ccnc2' "H-H": '[HH]' "H2": '[H][H]' "H2NiO2": '[Ni+2].[OH-].[OH-]' "H2NiO3": '[O-][O-].[Ni+2].O' "H2O": 'O' "H2O2": 'OO' "H2PO4": 'OP(=O)(O)O' "H2S": 'S' "H2S2O8": 'OOS(=O)(=O)OS(=O)(=O)O' "H2SO4": 'OS(=O)(=O)O' "H2SO5": 'O=S1(=O)OOOO1' "H2TeO4": 'O[Te](=O)(=O)O' "H3AsO3": 'O[As](O)O' "H3AsO4": 'O[As](=O)(O)O' "H3B": '[B]' "H3K5O18S4": '[O]OS(=O)(=O)O[KH].[O]OS(=O)(=O)O[KH].[K]OS(=O)(=O)O[K].[KH]OS(=O)(=O)[O]' "H3PO2": 'O[PH2]=O' "H3PO3": 'OP(=O)O' "H3PO4": 'OP(=O)(O)O' "HAP": '[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[OH-]' "HASA": 'NOS(=O)(=O)O' "HATU": 'F[P-](F)(F)(F)(F)F.CN(C(=[O+]n1nnc2c1nccc2)N(C)C)C' "HAuCl4": 'Cl[Au](Cl)Cl.Cl' "HBCD": 'BrC1CCC(Br)C(Br)CCC(C(CCC1Br)Br)Br' "HBF4.Et2O": 'F[B-](F)(F)F.CCOCC.[H+]' "HBGC": 'CCCC/N=C(\[N+](CCCC)(CCCC)CCCC)/N(CCCC)CCCC.[Cl-]' "HBGCl": 'CCCC/N=C(\[N+](CCCC)(CCCC)CCCC)/N(CCCC)CCCC.[Cl-]' "HBGF": 'CCCC/N=C(\[N+](CCCC)(CCCC)CCCC)/N(CCCC)CCCC.[F-]' "HBT": 'On1nnc2c1cccc2' "HBTU": 'F[P-](F)(F)(F)(F)F.CN(C(=[O+]n1nnc2c1cccc2)N(C)C)C' "HBr": 'Br' "HCA": 'O=C(C(Cl)(Cl)Cl)C(Cl)(Cl)Cl' "HCB": 'Clc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl' "HCH": 'ClC1C(Cl)C(Cl)C(C(C1Cl)Cl)Cl' "HCHO": 'C=O' "HCOOH": 'OC=O' "HCPT": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(cc4cc3Cn1c2=O)O' "HCQ": 'OCCN(CCCC(Nc1ccnc2c1ccc(c2)Cl)C)CC' "HCl": 'Cl' "HClO4": 'O[Cl](=O)(=O)=O' "HDNIB": '[O-][N+](=O)c1cc(ccc1S(=O)(=O)O[I](c1ccccc1)O)[N+](=O)[O-]' "HEBP": 'CCCCOP(=O)(OCCCC)OCCO' "HEDS": 'CCO[Si](O[Si](OCC)(OCC)OCC)(OCC)OCC' "HEGC": 'CC/N=C(\[N+](CC)(CC)CC)/N(CC)CC.[Cl-]' "HEGCl": 'CC/N=C(\[N+](CC)(CC)CC)/N(CC)CC.[Cl-]' "HEMA": 'CC(=C)C(=O)OCCO' "HENA": 'OC1CCC2(C(C1(C)C)CCC1(C2CC=C2C1(C)CCC1(C2CC(C)(CC1)C(=O)[O-])C)C)C.[Na+]' "HEP": 'OCCN1CCCC1' "HEPES": 'OCCN1CCN(CC1)CCS(=O)(=O)O' "HER": 'OC(=O)CCC(C(=O)NC(C(=O)O)CCCN=C(N)N)NC(=O)C(Cc1[nH]cnc1)N' "HEX": 'CCCCCC' "HF": '[Hf]' "HFA": 'O=C(C(F)(F)F)C(F)(F)F' "HFAH": 'O=C(C(F)(F)F)C(F)(F)F.O' "HFIP": 'OC(C(F)(F)F)C(F)(F)F' "HFP-DA": 'CCN(C(C(C(F)(F)F)F)(F)F)CC' "HI": 'I' "HIDA": 'ON(CC(=O)O)CC(=O)O' "HIDPA": 'CC(N(C(C(=O)O)C)O)C(=O)O' "HIO4": 'O[I](=O)(=O)=O' "HMDS": 'C[SiH](N([Si](C)(C)C)C)C' "HMDSO": 'C[Si](O[Si](C)(C)C)(C)C' "HMDTS": 'C[Si](S[Si](C)(C)C)(C)C' "HMF": 'OCc1ccc(o1)C=O' "HMPA": 'CN(P(=O)(N(C)C)N(C)C)C' "HMPT": 'CN(P(=O)(N(C)C)N(C)C)C' "HMT": 'C1N2CN3CN1CN(C2)C3' "HMTA": 'C1N2CN3CN1CN(C2)C3' "HMX": '[O-][N+](=O)N1CN(CN(CN(C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]' "HN": 'NC(C(=O)NC(C(=O)O)CC(=O)N)Cc1cnc[nH]1' "HN2": 'ClCCN(CCCl)C' "HNE": 'CCCCCC(C=CC=O)O' "HNIB": 'O[I](c1ccccc1)OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]' "HNO3": '[O-][N+](=O)O' "HO": '[Ho]' "HOAc": 'CC(=O)O' "HOBt": 'On1nnc2c1cccc2' "HOCH2OO": '[O]OCO' "HOCl": 'OCl' "HONO": 'ON=O' "HOOH": 'OO' "HOSA": 'NOS(=O)(=O)O' "HOSu": 'ON1C(=O)CCC1=O' "HPMA": 'CC(COC(=O)C(=C)C)O' "HPO": 'CCCCCC(=O)CP(=O)(O)O' "HPTE": 'ClC(C(c1ccc(cc1)O)c1ccc(cc1)O)(Cl)Cl' "HQ": 'Oc1ccc(cc1)O' "HSCN": 'SC#N' "HSYA": 'OCC1OC(C(C(C1O)O)O)C1=C(O)C(=C(C=Cc2ccc(cc2)O)O)C(=O)C(C1=O)(O)C1OC(CO)C(C(C1O)O)O' "HTIB": 'Cc1ccc(cc1)S(=O)(=O)O[I](c1ccccc1)O' "HVA": 'COc1cc(ccc1O)CC(=O)O' "Haematoxylin": 'Oc1cc2CC3(C(c2cc1O)c1ccc(c(c1OC3)O)O)O' "Hafnium": '[Hf]' "Hafnium(IV) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Hf+4]' "Haloperidol": 'Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl' "Harmaline": 'COc1ccc2=C3C(=C(C)NCC3)N=c2c1' "He": '[He]' "Helenalin": 'C=C1C(=O)OC2C1C(O)C1(C)C(=O)C=CC1C(C2)C' "Hematite": '[O-2].[O-2].[O-2].[Fe+3].[Fe+3]' "Hemopressin": 'NCCCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)Cc1[nH]cnc1)CO)CC(C)C)Cc1ccccc1)NC(=O)C(NC(=O)C(NC(=O)C(C(C)C)NC(=O)C1CCCN1)CC(=O)N)Cc1ccccc1' "Heptafluorobutyric Anhydride": 'O=C(C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F' "Heptafluorobutyryl Chloride": 'ClC(=O)C(C(C(F)(F)F)(F)F)(F)F' "Heptylmagnesium Bromide": 'CCCCCCC[Mg]Br' "Herbacetin": 'Oc1ccc(cc1)c1oc2c(O)c(O)cc(c2c(=O)c1O)O' "Heroin": 'CC(=O)OC1C=CC2C34C1Oc1c4c(CC2N(CC3)C)ccc1OC(=O)C' "Hesperidin": 'COc1ccc(cc1O)C1CC(=O)c2c(O1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "Hex": 'CCCCCC' "HexLi": '[Li]CCCCCC' "Hexachlorodisilane": 'Cl[Si]([Si](Cl)(Cl)Cl)(Cl)Cl' "Hexaconazole": 'CCCCC(c1ccc(cc1Cl)Cl)(Cn1cncn1)O' "Hexadecamethylcyclooctasiloxane": 'C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C' "Hexadecyltrimethoxysilane": 'CCCCCCCCCCCCCCCC[Si](OC)(OC)OC' "Hexadecyltrimethylammonium Bromide": 'CCCCCCCCCCCCCCCC[N+](C)(C)C.[Br-]' "Hexadecyltrimethylammonium Chloride": 'CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]' "Hexadecyltrimethylammonium Hydroxide": 'CCCCCCCCCCCCCCCC[N+](C)(C)C.[OH-]' "Hexafluoroacetylacetone": 'FCC(=O)C(C(=O)C(F)(F)F)(F)F' "Hexamethylbenzene": 'Cc1c(C)c(C)c(c(c1C)C)C' "Hexamethylcyclotrisiloxane": 'C[Si]1(C)O[Si](C)(C)O[Si](O1)(C)C' "Hexamethyldisilane": 'C[Si]([Si](C)(C)C)(C)C' "Hexamethyldisiloxane": 'C[Si](O[Si](C)(C)C)(C)C' "Hexamethylditin": 'C[Sn]([Sn](C)(C)C)(C)C' "Hexamethylenetetramine": 'C1N2CN3CN1CN(C2)C3' "Hexamoll": 'CC(CCCCCCOC(=O)C1CCCCC1C(=O)OCCCCCCC(C)C)C' "Hexaphenylcyclotrisiloxane": 'c1ccc(cc1)[Si]1(O[Si](O[Si](O1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1' "Hexaphenyldisilane": 'c1ccc(cc1)[Si]([Si](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1' "Hexaphenyldisiloxane": 'c1ccc(cc1)[Si](c1ccccc1)(c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "Hexylboronic Acid": 'CCCCCCB(O)O' "Hexylmagnesium Bromide": 'CCCCCC[Mg]Br' "Hexyltriethoxysilane": 'CCCCCC[Si](OCC)(OCC)OCC' "Hexyltrimethoxysilane": 'CCCCCC[Si](OC)(OC)OC' "Hexyltrimethylammonium Bromide": 'CCCCCC[N+](C)(C)C.[Br-]' "Hf": '[Hf]' "Hg": '[Hg]' "HgCl2": 'Cl[Hg]Cl' "Hinokitiol": 'CC(c1cccc(c(=O)c1)O)C' "Hirsutenone": 'O=C(CCc1ccc(c(c1)O)O)C=CCCc1ccc(c(c1)O)O' "His": 'N[C@H](C(=O)O)Cc1c[nH]cn1' "Histamine": 'NCCc1cnc[nH]1' "Histidine": 'NC(C(=O)O)Cc1cnc[nH]1' "Honokiol": 'C=CCc1ccc(c(c1)c1ccc(c(c1)CC=C)O)O' "HyT": 'Fc1c(NC(=O)c2nn([nH]c2=O)C)c(F)c(c(c1F)c1ccccc1)F' "Hydriodic Acid": 'I' "Hydrochloric Acid": 'Cl' "Hydrogen Bromide": 'Br' "Hydrogen Chloride": 'Cl' "Hydroquinidine Hydrochloride": 'CC[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1ccnc2c1cc(OC)cc2)O.Cl' "Hydroxyapatite": '[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[OH-]' "Hydroxylamine-O-sulfonic Acid": 'NOS(=O)(=O)O' "Hyperforin": 'CC(=CCCC1(C)C(CC=C(C)C)CC2(C(=O)C1(C(=O)C(C)C)C(=O)C(=C2O)CC=C(C)C)CC=C(C)C)C' "Hypericin": 'Oc1cc(C)c2c3c1C(=O)c1c(O)cc(c4c1c3c1c3c2c(C)cc(c3C(=O)c2c1c4c(O)cc2O)O)O' "Hyperinakin": 'CC(=CCCC1(C)OC1Cc1c(O)cc(c(c1O)C(=O)c1ccccc1)O)C' "I0801 (S)-4-Isopropyl-3-(1-naphthylmethyl)-2,5,5-triphenyl-1,3,2-oxazaborolidine (ca. 6% in Toluene,ca. 0.1mol/L)": 'CC([C@@H]1N(Cc2cccc3c2cccc3)B(OC1(c1ccccc1)c1ccccc1)c1ccccc1)C' "I2": 'II' "I3C": 'OCc1c[nH]c2c1cccc2' "IAA": 'OC(=O)Cc1c[nH]c2c1cccc2' "IBC": 'c1[nH]cc[nH+]1.[O-][Cr](=O)(=O)Br' "IBU": 'CC(Cc1ccc(cc1)C(C(=O)O)C)C' "IBX": 'O=C1O[I](=O)(c2c1cccc2)O' "ICC": 'c1[nH]cc[nH+]1.[O-][Cr](=O)(=O)Cl' "ICG": '[O-]S(=O)(=O)CCCCN1c2ccc3c(c2C(C1=CC=CC=CC=CC1=[N+](CCCCS(=O)(=O)[O-])c2c(C1(C)C)c1ccccc1cc2)(C)C)cccc3.[Na+]' "ICl": 'ClI' "ICy": 'C1CCC(CC1)N1C=CN([C]1)C1CCCCC1' "IDA": 'OC(=O)CNCC(=O)O' "IDCH": 'F[P-](F)(F)(F)(F)F.Cc1c(C)ccnc1C.Cc1c(C)ccnc1C.[IH2+]' "IF5-Pyridine-HF": 'c1cccnc1.F[I](F)(F)(F)F.F' "IFC": 'c1[nH]cc[nH+]1.[O-][Cr](=O)(=O)F' "IHN": 'CC(CC(C(CC(=O)NC(C(=O)NC(C(CC(=O)O)O)CC(C)C)C)O)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)C' "IMC": 'OC1CC(OC1COP(=O)(O)O)n1cc(C)c(=O)nc1N' "IMes": 'Cc1cc(C)cc(c1N1C=CN([C]1)c1c(C)cc(cc1C)C)C' "IN3": '[N-]=[N+]=NI' "INH": 'NNC(=O)c1ccncc1' "IO": 'O=Nc1c([nH]c2c1cccc2)C1C(=O)Nc2c1cccc2' "IPA": 'CC(O)C' "IPA3": 'Oc1ccc2c(c1SSc1c(O)ccc3c1cccc3)cccc2' "IPCC": 'CC(=C)OC(=O)Cl' "IPCF": 'CC(=C)OC(=O)Cl' "IPDI": 'O=C=NCC1(C)CC(N=C=O)CC(C1)(C)C' "IPTG": 'OCC1OC(SC(C)C)C(C(C1O)O)O' "IPr": 'CC(c1cccc(c1N1C=CN([C]1)c1c(cccc1C(C)C)C(C)C)C(C)C)C' "ISDN": '[O-][N+](=O)OC1COC2C1OCC2O[N+](=O)[O-]' "ISO": 'CC(c1ccc(cc1)N)C' "ITMS": 'C[Si](I)(C)C' "ITZ": 'CCC(n1ncn(c1=O)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)OCC1COC(O1)(Cn1cncn1)c1ccc(cc1Cl)Cl)C' "IVM": 'COC1CC(OC2C(C)C=CC=C3COC4C3(O)C(C=C(C4O)C)C(=O)OC3CC(CC=C2C)OC2(C3)CCC(C(O2)C(CC)C)C)OC(C1OC1CC(OC)C(C(O1)C)O)C' "Ibandronate": 'CCCCCN(CCC(P(=O)(O)O)(P(=O)(O)O)O)C' "Iberverin": 'CSCCCN=C=S' "Ibuprofen": 'CC(Cc1ccc(cc1)C(C(=O)O)C)C' "Ifenprodil": 'Oc1ccc(cc1)C(C(N1CCC(CC1)Cc1ccccc1)C)O' "Ifosfamide": 'ClCCNP1(=O)OCCCN1CCCl' "Ile": 'CC[C@@H]([C@@H](C(=O)O)N)C' "Ile-Phe": 'CCC(C(C(=O)NC(C(=O)O)Cc1ccccc1)N)C' "Iluvien": 'OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)(C)C' "Im": 'c1ncc[nH]1' "Imidazole": 'c1ncc[nH]1' "Imipramine": 'CN(CCCN1c2ccccc2CCc2c1cccc2)C' "Imiquimod": 'CC(Cn1cnc2c1c1ccccc1nc2N)C' "In(OH)3": '[In+3].[OH-].[OH-].[OH-]' "InAs": '[As].[In]' "Inavir": 'CCCCCCCC(=O)OCC(C(C1OC(=CC(C1NC(=O)C)N=C(N)N)C(=O)O)OC)O' "Indacaterol": 'CCc1cc2CC(Cc2cc1CC)NCC(c1ccc(c2c1ccc(=O)[nH]2)O)O' "Indan": 'C1Cc2c(C1)cccc2' "Indene": 'c1ccc2c(c1)C=CC2' "Indigotin": 'O=C1c2ccccc2NC1=C1Nc2c(C1=O)cccc2' "Indoline": 'c1ccc2c(c1)NCC2' "Indomethacin": 'COc1ccc2c(c1)c(CC(=O)O)c(n2C(=O)c1ccc(cc1)Cl)C' "Inegy": 'Oc1ccc(cc1)C1C(CCC(c2ccc(cc2)F)O)C(=O)N1c1ccc(cc1)F.CCC(C(=O)OC1CC(C)C=C2C1C(CCC1CC(O)CC(=O)O1)C(C=C2)C)(C)C' "Inosine": 'OCC1OC(C(C1O)O)n1cnc2c1[nH]cnc2=O' "Iodine": 'II' "Iodobenzene Diacetate": 'Ic1ccccc1.CC(=O)O.CC(=O)O' "Iodogen": 'ClN1C(=O)N(C2(C1(c1ccccc1)N(Cl)C(=O)N2Cl)c1ccccc1)Cl' "Iodomesitylene Diacetate": 'Cc1cc(C)c(c(c1)C)I.CC(=O)O.CC(=O)O' "Iodosodilactone": 'O=C1O[I]2c3c1cccc3C(=O)O2' "Iodothyronine": 'INC(C(=O)O)Cc1ccc(cc1)Oc1ccc(cc1)O' "Ipc2BH": 'CC1C(BC2CC3CC(C2C)C3(C)C)CC2CC1C2(C)C' "Iprodione": 'CC(NC(=O)N1CC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl)C' "Ir": '[Ir]' "IrCl3": '[Cl-].[Cl-].[Cl-].[Ir+3]' "Irbesartan": 'CCCCC1=NC2(C(=O)N1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CCCC2' "Iridium": '[Ir]' "Iridium(III) Chloride Hydrate": '[Cl-].[Cl-].[Cl-].[Ir+3].O' "Iron": '[Fe]' "Iron(II) Acetate": '[O-]C(=O)C.[O-]C(=O)C.[Fe+2]' "Ishikawa's Reagent": 'CCN(C(C(C(F)(F)F)F)(F)F)CC' "Isobutylboronic Acid": 'OB(CC(C)C)O' "Isobutylmagnesium Bromide": 'Br[Mg]CC(C)C' "Isocoumarin": 'O=c1occc2c1cccc2' "Isoflavone": 'O=c1c(coc2c1cccc2)c1ccccc1' "Isogentisin": 'COc1ccc2c(c1)c(=O)c1c(o2)cc(cc1O)O' "Isoidide": 'OC1COC2C1OCC2O' "Isoleucine": 'CCC(C(C(=O)O)N)C' "Isoliquiritigenin": 'Oc1ccc(cc1)C=CC(=O)c1ccc(cc1O)O' "Isoliquiritin": 'OCC1OC(Oc2ccc(cc2)C=CC(=O)c2ccc(cc2O)O)C(C(C1O)O)O' "Isoniazid": 'NNC(=O)c1ccncc1' "Isoorientin": 'OCC1OC(C(C(C1O)O)O)c1c(O)cc2c(c1O)c(=O)cc(o2)c1ccc(c(c1)O)O' "Isopropenyloxytris(trimethylsilyl)silane": 'CC(=C)O[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C' "Isopropylboronic Acid": 'OB(C(C)C)O' "Isopropyldiphenylphosphine": 'CC(P(c1ccccc1)c1ccccc1)C' "Isopropylmagnesium Bromide": 'Br[Mg]C(C)C' "Isopropylmagnesium Chloride": 'Cl[Mg]C(C)C' "Isopropylmagnesium Chloride - Lithium Chloride": 'Cl[Mg]C(C)C.[Li+].[Cl-]' "Isoproterenol": 'CC(NCC(c1ccc(c(c1)O)O)O)C' "Isosorbide": 'OC1COC2C1OCC2O' "Isosteviol": 'OC(=O)C1(C)CCCC2(C1CCC13C2CCC(C3)(C(=O)C1)C)C' "Isotretinoin": 'CC(=CC=CC(=CC(=O)O)C)C=CC1=C(C)CCCC1(C)C' "Jaceosidin": 'COc1cc(ccc1O)c1cc(=O)c2c(o1)cc(c(c2O)OC)O' "Jakafi": 'OP(=O)(O)O.N#CCC(n1ncc(c1)c1ncnc2c1cc[nH]2)C1CCCC1' "Juglone": 'O=C1C=CC(=O)c2c1c(O)ccc2' "K-Selectride": 'CCC([BH-](C(CC)C)C(CC)C)C.[K+]' "K222": 'O=C(NC(C(=O)O)Cc1ccc(cc1)OC(C)(C)C)OCC1c2ccccc2-c2c1cccc2' "K2CO3": '[O-]C(=O)[O-].[K+].[K+]' "K2Cr2O7": '[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[K+].[K+]' "K2HPO4": '[O-]P(=O)(O)[O-].[K+].[K+]' "K2S2O4": '[O-]S(=O)S(=O)[O-].[K+].[K+]' "K2S2O8": '[O-]S(=O)(=O)OOS(=O)(=O)[O-].[K+].[K+]' "K3PO4": '[O-]P(=O)([O-])[O-].[K+].[K+].[K+]' "KAPA": '[NH-]CCCN.[K+]' "KATP": 'OC1C(COP(=O)(OP(=O)(OP(=O)(O)[O-])O)O)OC(C1O)n1cnc2c1ncnc2N.[K+]' "KAsF6": 'F[As-](F)(F)(F)(F)F.[K+]' "KBH4": '[K+].[BH4-]' "KBHT": 'Cc1cc(c(c(c1)C(C)(C)C)[O-])C(C)(C)C.[K+]' "KCN": '[C-]#N.[K+]' "KCl": '[Cl-].[K+]' "KDA": 'CC([N-]C(C)C)C.[K+]' "KDMAN": 'O=CC1(C=CCc2c1cccc2)[N-](C)C.[K+]' "KF": '[F-].[K+]' "KH2PO4": '[O-]P(=O)(O)O.[K+]' "KHMDS": 'C[Si]([N-][Si](C)(C)C)(C)C.[K+]' "KHSO4": '[O-]S(=O)(=O)O.[K+]' "KHSO5": 'OOS(=O)(=O)[O-].[K+]' "KHSO5.0.5KHSO4.0.5K2SO4": '[O]OS(=O)(=O)O[KH].[O]OS(=O)(=O)O[KH].[K]OS(=O)(=O)O[K].[KH]OS(=O)(=O)[O]' "KI": '[K+].[I-]' "KIPBH": 'CC(O[BH-](OC(C)C)OC(C)C)C.[K+]' "KMBA": 'C[N-]CCCC.[K+]' "KMnO4": '[O-][Mn](=O)(=O)=O.[K+]' "KNO3": '[O-][N+](=O)[O-].[K+]' "KOAc": '[O-]C(=O)C.[K+]' "KOAt": '[O-]n1nnc2c1nccc2.[K+]' "KOBT": '[O-]n1nnc2c1cccc2.[K+]' "KOEt": '[O-]CC.[K+]' "KOH": '[K+].[OH-]' "KOMe": '[O-]C.[K+]' "KOtBu": '[O-]C(C)(C)C.[K+]' "KReO4": '[O-][Re](=O)(=O)=O.[K+]' "KRuO4": '[O-][Ru](=O)(=O)=O.[K+]' "KS-Selectride": 'CCCCC[BH-](CCCCC)CCCCC.[K+]' "KSCN": '[S-]C#N.[K+]' "KTC": 'CCCCCCCCC(=O)CCCCCCCCC(=O)O' "KYN": 'OC(=O)C(CC(=O)c1ccccc1N)N' "KYNA": 'OC(=O)c1cc(=O)c2c([nH]1)cccc2' "Kainate": 'OC(=O)CC1C(CNC1C(=O)O)C(=C)C' "Kanamycin": 'OCC1OC(OC2C(N)CC(C(C2O)OC2OC(CN)C(C(C2O)O)O)N)C(C(C1O)N)O' "Kaolinite": 'O=[Al]O[Al]=O.O=[Si]=O' "Ketamine": 'CNC1(CCCCC1=O)c1ccccc1Cl' "Ketoprofen": 'OC(=O)C(c1cccc(c1)C(=O)c1ccccc1)C' "Kr": '[Kr]' "Kynurenine": 'OC(=O)C(CC(=O)c1ccccc1N)N' "L-(+)-Leucinol": 'OC[C@H](CC(C)C)N' "L-(+)-Tartaric Acid": 'O[C@H]([C@H](C(=O)O)O)C(=O)O' "L-(-)-Threonine": 'C[C@H]([C@@H](C(=O)O)N)O' "L-Alanine": 'C[C@@H](C(=O)O)N' "L-Ascorbic Acid": 'OC[C@@H]([C@H]1OC(=O)C(=C1O)O)O' "L-Azetidine-2-carboxylic Acid [Antagonist ofL-Proline]": 'OC(=O)C1CCN1' "L-BMAA": 'CNCC(C(=O)O)N' "L-Carnitine": 'OC(C[N+](C)(C)C)CC(=O)[O-]' "L-DOPA": 'OC(=O)C(Cc1ccc(c(c1)O)O)N' "L-Lactic Acid": 'OC(=O)C(O)C' "L-Methionine": 'CSCC[C@@H](C(=O)O)N' "L-NAME": 'COC(=O)C(CCCN=C(N[N+](=O)[O-])N)N' "L-Phenylalanine": 'N[C@H](C(=O)O)Cc1ccccc1' "L-Pipecolic Acid": 'OC(=O)C1CCCCN1' "L-Prolinamide": 'NC(=O)[C@@H]1CCCN1' "L-Prolinanilide": 'O=C([C@@H]1CCCN1)Nc1ccccc1' "L-Proline": 'OC(=O)[C@@H]1CCCN1' "L-Selectride": 'CCC([BH-](C(CC)C)C(CC)C)C.[Li+]' "L-T4": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "L-Thioproline": 'OC(=O)[C@H]1NCCC1=S' "L-Tryptophan": 'OC(=O)[C@H](Cc1c[nH]c2c1cccc2)N' "L-alanine": 'CC(C(=O)O)N' "L-arginine": 'OC(=O)C(CCCN=C(N)N)N' "L-asparagine": 'NC(=O)CC(C(=O)O)N' "L-carnitine": 'OC(C[N+](C)(C)C)CC(=O)[O-]' "L-cysteine": 'NC(C(=O)O)CS' "L-lysine": 'NCCCCC(C(=O)O)N' "L-ornithine": 'NC(C(=O)O)CCCN' "L-selenomethionine": 'C[Se]CCC(C(=O)O)N' "L-thyroxine": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "L-tyrosine": 'OC(=O)C(Cc1ccc(cc1)O)N' "LAB": 'OCC1NCC(C1O)O' "LAG": 'OCC1OC(OC2C(CO)N=C(C(C2O)O)NO)C(C(C1OC1OC(CO)C(C(C1O)O)O)O)O' "LAH": '[H-].[H-].[H-].[Li].[Al+3]' "LAP": 'CCCCCCCCCCCC(=O)O' "LCA": 'OC1CCC2(C(C1)CCC1C2CCC2(C1CCC2C(CCC(=O)O)C)C)C' "LDA": 'CC([N-]C(C)C)C.[Li+]' "LDAO": 'CCCCCCCCCCCC[N+](C)(C)[O-]' "LDBB": 'CC(C1=CC[C-](C=C1)[C-]1CC=C(C=C1)C(C)(C)C)(C)C.[Li+].[Li+]' "LDBPA": 'CC(C[AlH-](N1CCCCC1)CC(C)C)C.[Li+]' "LDMAN": 'O=CC1(C=CCc2c1cccc2)[N-](C)C.[Li+]' "LEVOTHYROXINE": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "LEX": 'OCC1OC(O)C(C(C1OC1OC(CO)C(C(C1O)O)O)OC1OC(C)C(C(C1O)O)O)NC(=O)C' "LHMDS": 'C[Si]([N-][Si](C)(C)C)(C)C.[Li+]' "LICA": 'CC([N-]C1CCCCC1)C.[Li+]' "LIDBB": 'CC(C1=CC[C-](C=C1)[C-]1CC=C(C=C1)C(C)(C)C)(C)C.[Li+].[Li+]' "LIPC": 'CC([N-]C1CCCCC1)C.[Li+]' "LMN": 'CCCCCCCCCCC(COC1OC(CO)C(C(C1O)O)OC1OC(CO)C(C(C1O)O)O)(COC1OC(CO)C(C(C1O)O)OC1OC(CO)C(C(C1O)O)O)CCCCCCCCCC' "LNB": 'CCCCCC=C([N+](=O)[O-])CC=CCCCCCCCC(=O)O' "LPI": 'OC(COC(=O)C)COP(=O)(OC1C(O)C(O)C(C(C1O)O)O)O' "LPV": 'O=C(NC(C(CC(Cc1ccccc1)NC(=O)C(N1CCCNC1=O)C(C)C)O)Cc1ccccc1)COc1c(C)cccc1C' "LS-Selectride": 'CCCCC[BH-](CCCCC)CCCCC.[Li+]' "LSC": 'CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(OCC[N+](C)(C)C)O)O' "LSD": 'CCN(C(=O)C1CN(C)C2C(=C1)c1cccc3c1c(C2)c[nH]3)CC' "LSTc": 'OCC(C(C(C(C=O)O)O)OC1OC(CO)C(C(C1O)OC1OC(CO)C(C(C1NC(=O)C)O)OC1OC(COC2(CC(O)C(C(O2)C(C(CO)O)O)NC(=O)C)C(=O)O)C(C(C1O)O)O)O)O' "LT4": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "LTA": '[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[Pb+4]' "LTB5": 'CCC=CCC=CCC(C=CC=CC=CC(CCCC(=O)O)O)O' "LTBTA": 'CC([N-]C(c1ccccc1)(c1ccccc1)c1ccccc1)(C)C.[Li+]' "LTDHA": 'CCCCCCN([Al](N(CCCCCC)CCCCCC)N(CCCCCC)CCCCCC)CCCCCC.[H-].[Li+]' "LTMA": 'CO[Al](OC)OC.[H-].[Li+]' "LTMP": 'CC1(C)CCCC([N-]1)(C)C.[Li+]' "LVM": 'OCC1OC(C(C1OC1OC(CN)C(C(C1N)O)OC1OC(CO)C(C(C1O)O)O)O)OC1C(O)C(N)CC(C1OC1OC(CO)C(CC1N)O)N' "LXA4": 'CCCCCC(C=CC=CC=CC=CC(C(CCCC(=O)O)O)O)O' "La": '[La]' "La(OH)3": '[La+3].[OH-].[OH-].[OH-]' "Labdane": 'CCC(CCC1C(C)CCC2C1(C)CCCC2(C)C)C' "LacdiNAc": 'OCC1OC(O)C(C(C1OC1OC(CO)C(C(C1NC(=O)C)O)O)O)NC(=O)C' "Lamivudine": 'Nc1ccn(c(=O)n1)C1CSC(O1)CO' "Laninamivir": 'OCC(C(C1OC(=CC(C1NC(=O)C)N=C(N)N)C(=O)O)OC)O' "Lanostane": 'CC(CCCC(C1CCC2(C1(C)CCC1C2CCC2C1(C)CCCC2(C)C)C)C)C' "Lanthanum": '[La]' "Lanthanum(III) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[La+3]' "Lapatinib": 'Fc1cccc(c1)COc1ccc(cc1Cl)Nc1ncnc2c1cc(cc2)c1ccc(o1)CNCCS(=O)(=O)C' "Laponite": '[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[Li+].[Li+].[Na+].[Na+].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-]' "Laquinimod": 'CCN(C(=O)c1c(O)c2c(Cl)cccc2n(c1=O)C)c1ccccc1' "Lasiodiplodin": 'COc1cc(O)cc2c1C(=O)OC(C)CCCCCCC2' "Laulimalide": 'C=C1CC(C)CC2CC=CC(O2)CC=CC(=O)OC(CC2C(C(C1)O)O2)C(C=CC1OCC=C(C1)C)O' "Laurdan": 'CCCCCCCCCCCC(=O)c1ccc2c(c1)ccc(c2)N(C)C' "Lead Tetraacetate": '[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[Pb+4]' "Lead(II) Iodide": '[I-].[I-].[Pb+2]' "Leu": 'N[C@H](C(=O)O)CC(C)C' "Leucine": 'NC(C(=O)O)CC(C)C' "Levomilnacipran": 'NCC1CC1(c1ccccc1)C(=O)N(CC)CC' "Levonorgestrel": 'C#CC1(O)CCC2C1(CC)CCC1C2CCC2=CC(=O)CCC12' "Levothyroxine": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "Li": '[Li]' "Li2O2": '[O-][O-].[Li+].[Li+]' "Li2S": '[Li+].[Li+].[SH-]' "Li2Se": '[Li][Se][Li]' "Li2Se2": '[Li][Se][Se][Li]' "LiAlH4": '[H-].[H-].[H-].[Li].[Al+3]' "LiBH4": '[Li+].[BH4-]' "LiBr": '[Li+].[Br-]' "LiCl": '[Li+].[Cl-]' "LiDBB": 'CC(C1=CC[C-](C=C1)[C-]1CC=C(C=C1)C(C)(C)C)(C)C.[Li+].[Li+]' "LiHMDS": 'C[Si]([N-][Si](C)(C)C)(C)C.[Li+]' "LiICA": 'CC([N-]C1CCCCC1)C.[Li+]' "LiN3": '[N-]=[N+]=[N-].[Li+]' "LiNH2": '[Li+].[NH2-]' "LiOH": '[Li+].[OH-]' "LiPF6": 'F[P-](F)(F)(F)(F)F.[Li+]' "LiTMP": 'CC1(C)CCCC([N-]1)(C)C.[Li+]' "Lidocaine": 'CCN(CC(=O)Nc1c(C)cccc1C)CC' "Linarin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "Lindane": 'ClC1C(Cl)C(Cl)C(C(C1Cl)Cl)Cl' "Liquiritigenin": 'Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2)O' "Lisinopril": 'NCCCCC(C(=O)N1CCCC1C(=O)O)NC(C(=O)O)CCc1ccccc1' "Lithium (E)-4-oxopent-2-en-2-olate": '[O-]/C(=C/C(=O)C)/C.[Li+]' "Lithium Acetylide Ethylenediamine Complex": 'NCCN.[C-]#[C-].[Li+].[Li+]' "Lithium Aluminum Hydride": '[H-].[H-].[H-].[H-].[Li+].[Al+3]' "Lithium Bis(trimethylsilyl)amide": 'C[Si]([N-][Si](C)(C)C)(C)C.[Li+]' "Lithium Borohydride": '[Li+].[BH4-]' "Lithium Diisopropylamide": 'CC([N-]C(C)C)C.[Li+]' "Lithium Diphenylphosphide (ca. 0.5mol/L in Tetrahydrofuran)": 'c1ccc(cc1)[P-]c1ccccc1.[Li+]' "Lithium Tri-tert-butoxyaluminum Hydride": 'CC(O[Al](OC(C)(C)C)OC(C)(C)C)(C)C.[H-].[Li+]' "Lithium Triethylborohydride": 'CC[BH-](CC)CC.[Li+]' "Lithiumtert-Butoxide": '[O-]C(C)(C)C.[Li+]' "Litorin": 'CSCCC(C(=O)N)NC(=O)C(NC(=O)C(Cc1[nH]cnc1)NC(=O)CNC(=O)C(C(C)C)NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C1CCC(=O)N1)CCC(=O)N)C)Cc1ccccc1' "Lorcaserin": 'Clc1ccc2c(c1)C(C)CNCC2' "Losmapimod": 'O=C(c1ccc(nc1)c1cc(cc(c1C)F)C(=O)NC1CC1)NCC(C)(C)C' "Lu-177": '[Lu]' "Lucidone": 'COC1=CC(=O)C(=C1O)C(=O)C=Cc1ccccc1' "Luminol": 'Nc1cccc2c1c(=O)[nH][nH]c2=O' "Lupenone": 'CC(=C)C1CCC2(C1C1CCC3C(C1(C)CC2)(C)CCC1C3(C)CCC(=O)C1(C)C)C' "Lupinifolin": 'CC(=CCc1c2OC(CC(=O)c2c(c2c1OC(C)(C)C=C2)O)c1ccc(cc1)O)C' "Lurasidone": 'O=C1N(CC2CCCCC2CN2CCN(CC2)c2nsc3c2cccc3)C(=O)C2C1C1CCC2C1' "Lusedra": 'CC(c1cccc(c1OCOP(=O)([O-])[O-])C(C)C)C.[Na+].[Na+]' "Luteolin": 'Oc1cc(O)c2c(c1)oc(cc2=O)c1ccc(c(c1)O)O' "Lycopene": 'CC(=CC=CC=C(C=CC=C(C=CC=C(CCC=C(C)C)C)C)C)C=CC=C(C=CC=C(CCC=C(C)C)C)C' "Lyral": 'O=CC1CCC(=CC1)CCCC(O)(C)C' "Lys": 'NCCCC[C@@H](C(=O)O)N' "Lys-Asp-Glu-Leu": 'NCCCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)CC(C)C)CCC(=O)O)CC(=O)O)N' "MA": 'COC(=O)C=C' "MADP": '[O-]c1ccccc1.[O-]c1ccccc1.C[Al+2]' "MADPP": '[O-]c1c(cccc1c1ccccc1)c1ccccc1.[O-]c1c(cccc1c1ccccc1)c1ccccc1.C[Al+2]' "MAH": 'O=C1C=CC(=O)O1' "MAN": 'OCC1OC(O)C(C(C1O)O)O' "MAO": 'C[AlH]O[AlH2]' "MAPH": '[O-]c1c(cccc1c1ccccc1)c1ccccc1.[O-]c1c(cccc1c1ccccc1)c1ccccc1.C[Al+2]' "MBA": 'COc1ccc(cc1)/C=N/c1ccc(cc1)OC(=O)C' "MBT": 'S=c1sc2c([nH]1)cccc2' "MC": 'ClCCl' "MC-RR": 'COC(C(C=C(C=CC1NC(=O)C(CCCN=C(N)N)NC(=O)C(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC(=O)C1C)C(=O)O)C)C)C(=O)O)C)C)Cc1ccccc1' "MCC": 'COC(=O)Nc1ccc(c(c1)Cl)Cl' "MCF": 'COC(=O)Cl' "MCPBA": 'OOC(=O)c1cccc(c1)Cl' "MDI": 'O=C=Nc1ccc(cc1)Cc1ccc(cc1)N=C=O' "MDMA": 'CNC(Cc1ccc2c(c1)OCO2)C' "MDO": 'C=C1OCCCCO1' "MDPV": 'CCCC(C(=O)c1ccc2c(c1)OCO2)N1CCCC1' "MDS": 'C[Si](N[Si](C)(C)C)(C)C' "MDZ": 'O=C(NC(C(=O)OC(C(=O)O)C(C)C)C(S)C)CCCC(C(=O)O)N' "MEC": 'CCNC(=O)OC' "MED": 'CSCCC(C(=O)O)N' "MEHP": 'CCCCC(COC(=O)c1ccccc1C(=O)O)CC' "MEK": 'CCC(=O)C' "MEL": 'OC(=O)CNC(C(=O)N1CCC1C(=O)NCc1ccc(cc1)C(=N)N)C1CCCCC1' "MES": 'OS(=O)(=O)CCN1CCOCC1' "MESNA": 'SCCS(=O)(=O)[O-].[Na+]' "METH": 'CNC(Cc1ccccc1)C' "MGS": 'OCCC(C(=O)NC1C(C)OC(C(C1O)OC)OC)O' "MHH": 'CCCCCCP(=O)(OC)O' "MHPG": 'OCC(c1ccc(c(c1)OC)O)O' "MIBK": 'CC(CC(=O)C)C' "MICA": 'CC([N-]C1CCCCC1)C.CC([N-]C1CCCCC1)C.[Mg+2]' "MIF-1": 'CC(CC(C(=O)NCC(=O)N)NC(=O)C1CCCN1)C' "MIM": 'Cn1cncc1' "MINA": 'CC(=O)C=NO' "MMA": 'COC(=O)C(=C)C' "MMB-4": 'O=[NH+]C=C1C=CN(C=C1)CN1C=CC(=C[NH+]=O)C=C1.[Br-].[Br-]' "MMC": 'COC12C3NC3CN2C2=C(C1COC(=O)N)C(=O)C(=C(C2=O)C)N' "MMF": 'CNC=O' "MMI": 'COCc1c[nH]c2c1cccc2' "MMPIP": 'COc1ccc(cc1)c1cc2onc(c2c(=O)n1C)c1ccncc1' "MMS": 'COS(=O)(=O)C' "MNG": 'O=NN(C(=N[N+](=O)[O-])N)C' "MNNG": 'O=NN(C(=N[N+](=O)[O-])N)C' "MNQ": 'O=C1C=C(C)C(=O)c2c1cccc2' "MNU": 'O=NN(C(=O)N)C' "MOP": 'CCCCCCCC(c1cc(O)c2c(c1)OC(C1=C2CC(C)CC1)(C)C)C' "MOPS": 'OS(=O)(=O)CCCN1CCOCC1' "MOPs": 'OS(=O)(=O)CCCN1CCOCC1' "MPAG": 'COc1c(CC=C(CCC(=O)O)C)c(OC2OC(C(=O)O)C(C(C2O)O)O)c2c(c1C)COC2=O' "MPEG": 'COCCO' "MPEP": 'Cc1cccc(n1)C#Cc1ccccc1' "MPPC": '[O-][Cr](=O)(=O)Cl.C[NH+]1CCCCC1' "MPPH": 'OOC(Cc1ccccc1)(C)C' "MPT": 'CN(c1ccccc1)N=NN(c1ccccc1)C' "MPTP": 'CN1CCC(=CC1)c1ccccc1' "MPTS": 'COc1cc(c2c3c1ccc1c3c(cc2)c(cc1S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]' "MSA": 'CS(=O)(=O)O' "MSH": 'ONS(=O)(=O)c1c(C)cc(cc1C)C' "MSNT": 'Cc1cc(C)c(c(c1)C)S(=O)(=O)c1cnnn1[N+](=O)[O-]' "MSTFA": 'CN([Si](C)(C)C)C(=O)C(F)(F)F' "MTA": 'CSCC1OC(C(C1O)O)n1cnc2c1ncnc2N' "MTB": 'COC(C)(C)C' "MTBE": 'COC(C)(C)C' "MTEP": 'Cc1scc(n1)C#Cc1cccnc1' "MTG": 'COC(=O)CS' "MTM": 'CSCC1NC(C(C1O)O)c1c[nH]c2c1ncnc2N' "MTO": 'C[Re](=O)(=O)=O' "MTPA": 'COC(C(F)(F)F)(c1ccccc1)C(=O)O' "MTPI": 'C[P+](Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1.[I-]' "MTSEA": 'CS(=S)(=O)OCCN' "MTT": 'Cc1sc(nc1C)[n+]1nc(nn1c1ccccc1)c1ccccc1.[Br-]' "MTX": 'OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C' "MUS": 'OCC(C(C1OC(CC(C1NC(=O)C)O)(Oc1ccc2c(c1)oc(=O)cc2C)C(=O)O)O)O' "MVK": 'CC(=O)C=C' "MXC": 'COc1ccc(cc1)C(C(Cl)(Cl)Cl)c1ccc(cc1)OC' "Macelignan": 'COc1cc(ccc1O)CC(C(Cc1ccc2c(c1)OCO2)C)C' "Magnetite": 'O[Fe]=O.O[Fe]=O.[Fe]' "Maleic Acid": 'OC(=O)/C=C\C(=O)O' "Malonaldehyde": 'O=CCC=O' "Malondialdehyde": 'O=CCC=O' "Malonic Acid": 'OC(=O)CC(=O)O' "Manganese": '[Mn]' "Manganese(II) Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.[Mn+2]' "Manganese(II) Chloride Tetrahydrate": '[Cl-].[Cl-].[Mn+2].O.O.O.O' "Mangiferin": 'OCC1OC(C(C(C1O)O)O)c1c(O)cc2c(c1O)c(=O)c1c(o2)cc(c(c1)O)O' "Mannitol": 'OCC(C(C(C(CO)O)O)O)O' "Maprotiline": 'CNCCCC12CCC(c3c1cccc3)c1c2cccc1' "Matrine": 'O=C1CCCC2N1CC1CCCN3C1C2CCC3' "Mds": 'COc1cc(C)cc(c1)C' "Me2S": 'CSC' "Me2SO": 'CS(=O)C' "Me2SO4": 'COS(=O)(=O)OC' "MeCN": 'CC#N' "MeH4Q": 'Oc1cc(C)c2c(n1)cccc2' "MeIQ": 'Cc1cc2ncccc2c2c1n(C)c(n2)N' "MeIQx": 'Cc1cnc2c(n1)c1nc(n(c1cc2)C)N' "MeLi": '[Li]C' "MeNH2": 'CN' "MeOH": 'CO' "MeS2Me": 'CSSC' "MeSSMe": 'CSSC' "Med": 'CSCCC(C(=O)O)N' "Melamine": 'Nc1nc(N)nc(n1)N' "Melatonin": 'COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2' "Memantine": 'CC12CC3CC(C1)(C)CC(C2)(C3)N' "Menthol": 'CC1CCC(C(C1)O)C(C)C' "Mephedrone": 'CNC(C(=O)c1ccc(cc1)C)C' "Mes": 'CC1=[C]C(=C(C(=C1)C)c1c(C)cc(cc1C)C)C' "Mesalamine": 'Nc1ccc(c(c1)C(=O)O)O' "Mesupron": 'CCOC(=O)N1CCN(CC1)C(=O)C(NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C)Cc1cccc(c1)C(=NO)N' "Met": 'CSCC[C@@H](C(=O)O)N' "Metformin": 'CN(C(=N)N=C(N)N)C' "Meth": 'CNC(Cc1ccccc1)C' "Methadone": 'CCC(=O)C(c1ccccc1)(c1ccccc1)CC(N(C)C)C' "Methallyltrimethylsilane": 'CC(=C)C[Si](C)(C)C' "Methamidophos": 'COP(=O)(SC)N' "Methamphetamine": 'CNC(Cc1ccccc1)C' "Methanesulfonic Acid": 'CS(=O)(=O)O' "Methicillin": 'COc1cccc(c1C(=O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C)OC' "Methiocarb": 'CNC(=O)Oc1cc(C)c(c(c1)C)SC' "Methional": 'CSCCC=O' "Methotrexate": 'OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C' "Methoxychlor": 'COc1ccc(cc1)C(C(Cl)(Cl)Cl)c1ccc(cc1)OC' "Methoxydimethyl(phenyl)silane": 'CO[Si](c1ccccc1)(C)C' "Methoxydiphenylphosphine": 'COP(c1ccccc1)c1ccccc1' "Methoxymethyl(diphenyl)phosphine Oxide": 'COCP(=O)(c1ccccc1)c1ccccc1' "Methoxymethyltrimethylsilane": 'COC[Si](C)(C)C' "Methoxytrimethylsilane": 'CO[Si](C)(C)C' "Methyl 3-(Trimethylsilyloxy)crotonate (cis- andtrans- mixture)": 'COC(=O)/C=C(\O[Si](C)(C)C)/C' "Methyl Chlorodifluoroacetate": 'COC(=O)C(Cl)(F)F' "Methyl Chloroglyoxylate": 'COC(=O)C(=O)Cl' "Methyl Difluoro(fluorosulfonyl)acetate": 'COC(=O)C(S(=O)(=O)F)(F)F' "Methyl(diphenyl)phosphine Oxide": 'CP(=O)(c1ccccc1)c1ccccc1' "Methylamine": 'CN' "Methylboronic Acid": 'CB(O)O' "Methyldiphenylphosphine": 'CP(c1ccccc1)c1ccccc1' "Methyldiphenylsilane": 'C[SiH](c1ccccc1)c1ccccc1' "Methyleugenol": 'C=CCc1ccc(c(c1)OC)OC' "Methylmagnesium Bromide": 'C[Mg]Br' "Methylmagnesium Iodide": 'C[Mg]I' "Methylone": 'CNC(C(=O)c1ccc2c(c1)OCO2)C' "Methyltri-n-octylammonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C' "Methyltri-n-octylammonium Chloride": 'CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C.[Cl-]' "Methyltri-n-octylammonium Hydrogen Sulfate": '[O-]S(=O)(=O)O.CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C' "Methyltriphenylarsonium Iodide": 'C[As+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]' "Metolachlor": 'COCC(N(c1c(C)cccc1CC)C(=O)CCl)C' "Metoprolol": 'COCCc1ccc(cc1)OCC(CNC(C)C)O' "Mg": '[Mg]' "Mg(OH)2": '[Mg+2].[OH-].[OH-]' "MgADP": 'OC1C(COP(=O)(OP(=O)(O)[O-])[O-])OC(C1O)n1cnc2c1ncnc2N.[Mg+2]' "MgBr2": '[Mg+2].[Br-].[Br-]' "MgCl2": '[Mg+2].[Cl-].[Cl-]' "MgI2": '[Mg+2].[I-].[I-]' "MgMn2O8": '[O-][Mn](=O)(=O)=O.[O-][Mn](=O)(=O)=O.[Mg+2]' "MgO2": '[O-][O-].[Mg+2]' "MgSO4": '[O-]S(=O)(=O)[O-].[Mg+2]' "Midazolam": 'Clc1ccc2-n3c(CN=C(c2c1)c1ccccc1F)cnc3C' "Mifepristone": 'CC#CC1(O)CCC2C1(C)CC(c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CCC21' "Miltirone": 'CC(C1=Cc2ccc3c(c2C(=O)C1=O)CCCC3(C)C)C' "Minocycline": 'CN(C1C(=O)C(=C(C2(C1CC1Cc3c(C(=C1C2=O)O)c(O)ccc3N(C)C)O)O)C(=O)N)C' "Mirtazapine": 'CN1CCN2C(C1)c1ccccc1Cc1c2nccc1' "Misoprostol": 'CCCCC(CC=CC1C(O)CC(=O)C1CCCCCCC(=O)OC)(O)C' "Mith": 'COC(C1Cc2cc3cc(OC4OC(C)C(C(C4)OC4CC(O)C(C(O4)C)O)O)c(c(c3c(c2C(=O)C1OC1OC(C)C(C(C1)OC1OC(C)C(C(C1)OC1OC(C)C(C(C1)(C)O)O)O)O)O)O)C)C(=O)C(C(O)C)O' "Mithramycin": 'COC(C1Cc2cc3cc(OC4OC(C)C(C(C4)OC4CC(O)C(C(O4)C)O)O)c(c(c3c(c2C(=O)C1OC1OC(C)C(C(C1)OC1OC(C)C(C(C1)OC1OC(C)C(C(C1)(C)O)O)O)O)O)O)C)C(=O)C(C(O)C)O' "Mitoxantrone": 'OCCNCCNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)NCCNCCO' "Mitragynine": 'COC=C(C1CC2N(CC1CC)CCc1c2[nH]c2c1c(OC)ccc2)C(=O)OC' "Mn": '[Mn]' "Mn3O4": 'O[Mn]=O.O[Mn]=O.[Mn]' "MnCl2": 'Cl[Mn]Cl' "MnCl2O8": '[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[Mn+2]' "MnMoO4": '[O-][Mo](=O)(=O)[O-].[Mn+2]' "MnO2": 'O=[Mn]=O' "MnSO4": '[O-]S(=O)(=O)[O-].[Mn+2]' "Mo": '[Mo]' "MoB": 'COc1ccc(c(c1)O)C(=O)c1ccccc1' "Modafinil": 'NC(=O)CS(=O)C(c1ccccc1)c1ccccc1' "Mollugin": 'COC(=O)c1c2C=CC(Oc2c2c(c1O)cccc2)(C)C' "Molybdenum": '[Mo]' "Moniliformin": 'OC1=CC(=O)C1=O' "Monobutyltin Oxide": 'CCCC[SnH]=O' "Monosodium Bromoisocyanurate Hydrate": 'Brc1[n-]c(=O)[nH]c(=O)n1.[Na+]' "Monotropein": 'OCC1OC(OC2OC=C(C3C2C(O)(CO)C=C3)C(=O)O)C(C(C1O)O)O' "Montmorillonite": 'O=[Si]=O.O=[Si]=O.O=[Si]=O.O=[Si]=O.[O-2].[O-2].[O-2].[Al+3].[Al+3].O' "Morin": 'Oc1ccc(c(c1)O)c1oc2cc(O)cc(c2c(=O)c1O)O' "Morphine": 'OC1C=CC2C34C1Oc1c4c(CC2N(CC3)C)ccc1O' "Morpholinosulfur Trifluoride": 'FS(N1CCOCC1)(F)F' "Moz": 'COc1ccc(cc1)CO[C]=O' "Mpm": 'COc1ccc(cc1)[CH2]' "Msib": '[CH2]c1ccc(cc1)S(=O)C' "Msz": 'O=[C]OCc1ccc(cc1)S(=O)C' "Myo-inositol": 'OC1C(O)C(O)C(C(C1O)O)O' "Myricetin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1cc(O)c(c(c1)O)O' "N'-Isopropylidene-2-nitrobenzenesulfonohydrazide": 'CC(=NNS(=O)(=O)c1ccccc1[N+](=O)[O-])C' "N,N',N''-Trimethyldiethylenetriamine": 'CNCCN(CCNC)C' "N,N'-Bis(2-aminobenzal)ethylenediamine": 'Nc1ccccc1/C=N/CC/N=C/c1ccccc1N' "N,N'-Bis(2-pyridylmethyl)-1,2-ethylenediamine Tetrahydrochloride Dihydrate": 'C(NCc1ccccn1)CNCc1ccccn1.Cl.Cl.Cl.Cl.O.O' "N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,1,2,2-tetramethylethylenediamine": 'Oc1c(/C=N/C(C(/N=C/c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)(C)C)(C)C)cc(cc1C(C)(C)C)C(C)(C)C' "N,N'-Bis(5-hydroxysalicylidene)ethylenediamine": 'Oc1ccc(cc1/C=N/CC/N=C/c1cc(O)ccc1O)O' "N,N'-Bis(salicylidene)-1,2-phenylenediamine": 'Oc1ccccc1/C=N/c1ccccc1/N=C/c1ccccc1O' "N,N'-Bis(salicylidene)-1,2-propanediamine": 'CC(/N=C/c1ccccc1O)C/N=C/c1ccccc1O' "N,N'-Bis(salicylidene)-1,3-propanediamine": 'Oc1ccccc1/C=N/CCC/N=C/c1ccccc1O' "N,N'-Bis(salicylidene)ethylenediamine": 'Oc1ccccc1/C=N/CC/N=C/c1ccccc1O' "N,N'-Di-tert-butylcarbodiimide": 'CC(N=C=NC(C)(C)C)(C)C' "N,N'-Di-tert-butylethylenediamine": 'CC(NCCNC(C)(C)C)(C)C' "N,N'-Dicyclohexyl-1,2-ethanediamine Hydrate": 'C1CCC(CC1)NCCNC1CCCCC1.O' "N,N'-Dicyclohexylcarbodiimide": 'C1CCC(CC1)N=C=NC1CCCCC1' "N,N'-Diisopropylcarbodiimide": 'CC(N=C=NC(C)C)C' "N,N'-Dimethylethylenediamine": 'CNCCNC' "N,N'-Diphenylethylenediamine": 'C(Nc1ccccc1)CNc1ccccc1' "N,N,N',N'-Tetraethylethylenediamine": 'CCN(CCN(CC)CC)CC' "N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine": 'c1ccc(nc1)CN(Cc1ccccn1)CCN(Cc1ccccn1)Cc1ccccn1' "N,N,N',N'-Tetramethyl-1,3-diaminopropane": 'CN(CCCN(C)C)C' "N,N,N',N'-Tetramethyl-1,4-diaminobutane": 'CN(CCCCN(C)C)C' "N,N,N',N'-Tetramethyl-1,6-diaminohexane": 'CN(CCCCCCN(C)C)C' "N,N,N',N'-Tetramethyl-O-(N-succinimidyl)uronium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN(C(=[O+]N1C(=O)CCC1=O)N(C)C)C' "N,N,N',N'-Tetramethyl-O-(N-succinimidyl)uronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[O+]N1C(=O)CCC1=O)N(C)C)C' "N,N,N',N'-Tetramethyl-S-(1-oxido-2-pyridyl)thiouronium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN(C(=[S+]c1cccc[n+]1[O-])N(C)C)C' "N,N,N',N'-Tetramethyl-S-(1-oxido-2-pyridyl)thiouronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[S+]c1cccc[n+]1[O-])N(C)C)C' "N,N,N',N'-Tetramethylethylenediamine": 'CN(CCN(C)C)C' "N,N-Diethylaniline Borane": 'CCN(c1ccccc1)CC.B' "N,N-Diisopropylethylamine": 'CCN(C(C)C)C(C)C' "N,N-Dimethyl-N-(methylsulfanylmethylene)ammonium Iodide": 'CSC=[N+](C)C.[I-]' "N-(2-Pyridyl)bis(trifluoromethanesulfonimide)": 'O=S(=O)(C(F)(F)F)N(S(=O)(=O)C(F)(F)F)c1ccccn1' "N-(2-Thiophenesulfonyl)-L-prolinamide": 'O=C([C@@H]1CCCN1)NS(=O)(=O)c1cccs1' "N-(9-Deoxy-epi-cinchonidin-9-yl)picolinamide": 'C=CC1CN2CCC1C[C@H]2[C@H](c1ccnc2c1cccc2)NC(=O)c1ccccn1' "N-(9-Deoxy-epi-cinchonin-9-yl)picolinamide": 'C=CC1CN2CCC1CC2[C@@H](c1ccnc2c1cccc2)NC(=O)c1ccccn1' "N-(Trifluoromethylthio)phthalimide": 'FC(SN1C(=O)c2c(C1=O)cccc2)(F)F' "N-Benzylcinchonidinium Chloride": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1cc[n+](c2c1cccc2)Cc1ccccc1)O.[Cl-]' "N-Benzylcinchonidinium Chloride [Chiral Phase-Transfer Catalyst]": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1cc[n+](c2c1cccc2)Cc1ccccc1)O.[Cl-]' "N-Benzylcinchoninium Chloride": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1cc[n+](c2c1cccc2)Cc1ccccc1)O.[Cl-]' "N-Benzylcinchoninium Chloride [Chiral Phase-Transfer Catalyst]": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1cc[n+](c2c1cccc2)Cc1ccccc1)O.[Cl-]' "N-Benzylquinidinium Chloride": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1cc[n+](c2c1cc(OC)cc2)Cc1ccccc1)O.[Cl-]' "N-Benzylquinidinium Chloride [Chiral Phase-Transfer Catalyst]": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1cc[n+](c2c1cc(OC)cc2)Cc1ccccc1)O.[Cl-]' "N-Benzylquininium Chloride": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1cc[n+](c2c1cc(OC)cc2)Cc1ccccc1)O.[Cl-]' "N-Benzylquininium Chloride [Chiral Phase-Transfer Catalyst]": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1cc[n+](c2c1cc(OC)cc2)Cc1ccccc1)O.[Cl-]' "N-Bromoacetamide": 'CC(=O)NBr' "N-Bromophthalimide": 'BrN1C(=O)c2c(C1=O)cccc2' "N-Bromosaccharin": 'O=C1c2ccccc2S(=O)(=O)N1Br' "N-Bromosuccinimide": 'BrN1C(=O)CCC1=O' "N-Chlorophthalimide": 'ClN1C(=O)c2c(C1=O)cccc2' "N-Chlorosaccharin": 'O=C1c2ccccc2S(=O)(=O)N1Cl' "N-Chlorosuccinimide": 'ClN1C(=O)CCC1=O' "N-Fluoro-N'-(chloromethyl)triethylenediamine Bis(tetrafluoroborate)": 'F[B-](F)(F)F.F[B-](F)(F)F.ClC[N+]12CC[N+](CC1)(CC2)F' "N-Fluorobenzenesulfonimide": 'FN(S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1' "N-H": 'NC(C(=O)NC(C(=O)O)Cc1cnc[nH]1)CC(=O)N' "N-Hydroxy-5-norbornene-2,3-dicarboximide": 'ON1C(=O)C2C(C1=O)C1CC2C=C1' "N-Hydroxyphthalimide": 'ON1C(=O)c2c(C1=O)cccc2' "N-Hydroxysuccinimide": 'ON1C(=O)CCC1=O' "N-Hydroxysulfosuccinimide Sodium Salt": 'O=C1CC(C(=O)N1O)S(=O)(=O)[O-].[Na+]' "N-Iodosaccharin": 'O=C1c2ccccc2S(=O)(=O)N1I' "N-Iodosuccinimide": 'IN1C(=O)CCC1=O' "N-Me-Phe": 'CNC(C(=O)O)Cc1ccccc1' "N-Methyl-N-(trifluoromethylthio)aniline": 'CN(c1ccccc1)SC(F)(F)F' "N-Methylbis(trifluoroacetamide)": 'CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F' "N-N": 'NC(=O)CC(C(=O)NC(C(=O)O)CC(=O)N)N' "N-Phenylbis(trifluoromethanesulfonimide)": 'FC(S(=O)(=O)N(S(=O)(=O)C(F)(F)F)c1ccccc1)(F)F' "N-Salicylideneaniline": 'Oc1ccccc1/C=N/c1ccccc1' "N-Trimethylsilylimidazole": 'C[Si](n1cncc1)(C)C' "N-[(9S)-8-Cinchonan-9-yl]quinoline-8-sulfonamide": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1ccnc2c1cccc2)NS(=O)(=O)c1cccc2c1nccc2' "N-[2-(Trimethylsilyl)ethoxycarbonyloxy]succinimide": 'O=C(ON1C(=O)CCC1=O)OCC[Si](C)(C)C' "N-tert-Butyl-5-methylisoxazolium Perchlorate": '[O-][Cl](=O)(=O)=O.Cc1cc[n+](o1)C(C)(C)C' "N-tert-Butylbenzenesulfenamide": 'CC(NSc1ccccc1)(C)C' "N-tert-Butylbenzenesulfinimidoyl Chloride": 'CC(/N=S(/c1ccccc1)\Cl)(C)C' "N-trans-feruloyltyramine": 'COc1cc(C=CC(=O)NCCc2ccc(cc2)O)ccc1O' "N2": 'N#N' "N2H4": 'NN' "N2O": '[O-][N+]#N' "N3": 'OC(COc1ccc(cc1)Nc1ccccc1)COc1ccc(cc1)Nc1ccccc1' "N7-GA-Gua": 'NC(=O)C(Cn1cnc2c1c(=O)nc([nH]2)N)O' "NAA": 'OC(=O)Cc1cccc2c1cccc2' "NAAG": 'OC(=O)CCC(C(=O)O)NC(=O)C(NC(=O)C)CC(=O)O' "NAC": 'SCC(C(=O)O)NC(=O)C' "NADH": 'OC1C(O)C(OC1N1C=CCC(=C1)C(=O)N)COP(=O)(OP(=O)(OCC1OC(C(C1O)O)n1cnc2c1ncnc2N)O)O' "NAGly": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCC(=O)O' "NAL": 'OC(=O)C(Cc1ccc2c(c1)cccc2)N' "NAS": 'CC(=O)ON1C(=O)CCC1=O' "NASPM": 'NCCCNCCCCNCCCNC(=O)Cc1cccc2c1cccc2' "NB-2": 'OC(=O)c1ccc(cc1O)n1c(C)ccc1C' "NBA": 'CC(=O)NBr' "NBE": 'C1CC2CC1C=C2' "NBI": 'Cc1cc[n+](o1)C(C)(C)C' "NBP": 'CCCCN1CCCC1=O' "NBS": 'BrN1C(=O)CCC1=O' "NBSH": 'NNS(=O)(=O)c1ccccc1[N+](=O)[O-]' "NBT": 'COc1cc(ccc1[n+]1nc(nn1c1ccc(cc1)[N+](=O)[O-])c1ccccc1)c1ccc(c(c1)OC)[n+]1nc(nn1c1ccc(cc1)[N+](=O)[O-])c1ccccc1.[Cl-].[Cl-]' "NCA": 'ClN(c1ccccc1)C(=O)C' "NCFP": 'Clc1ccc(c(c1)CN1C(=O)c2c(C1=O)c(F)ccc2)NC(=O)c1ccccn1' "NCS": 'ClN1C(=O)CCC1=O' "NDA": 'CC([N-]C(C)C)C.[Na+]' "NDGA": 'CC(C(Cc1ccc(c(c1)O)O)C)Cc1ccc(c(c1)O)O' "NDHPI": 'O=c1c2cc3c(cc2c(=O)n1O)c(=O)n(c3=O)O' "NDI": 'O=C=Nc1c(N=C=O)ccc2c1cccc2' "NDMBA": 'CN1C(=O)CC(=O)N(C1=O)C' "NEM": 'CCN1CCOCC1' "NEP": 'CCN1CCCCC1' "NEt3": 'CCN(CC)CC' "NEt3.SO3": 'O=S(=O)=O.CCN(CC)CC' "NF3": 'FN(F)F' "NH2": 'N' "NH2OH": 'NO' "NH2OH.HCl": 'NO.Cl' "NH3": 'N' "NH4+BF4-": 'F[B-](F)(F)F.[NH4+]' "NH4BF4": 'F[B-](F)(F)F.[NH4+]' "NH4Cl": '[Cl-].[NH4+]' "NH4F": '[F-].[NH4+]' "NH4OH": '[OH-].[NH4+]' "NHN": 'CCCC(C(C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1)(O)O)NC(=O)C1CC2CN1C(=O)C(NC(=O)CCc1cc(OCCO2)ccc1)C1CCCCC1' "NHOH.HCl": 'NO.Cl' "NHPI": 'ON1C(=O)c2c(C1=O)cccc2' "NHS": 'ON1C(=O)CCC1=O' "NIE": '[O-][N+](=O)CC' "NIM": '[O-][N+](=O)c1ccc(c(c1)Oc1ccccc1)NS(=O)(=O)C' "NIPAM": 'C=CC(=O)NC(C)C' "NIPAm": 'C=CC(=O)NC(C)C' "NIS": 'IN1C(=O)CCC1=O' "NISac": 'O=C1c2ccccc2S(=O)(=O)N1I' "NIV": 'OCC12C(C=C(C(=O)C1O)C)OC1C3(C2(C)C(O)C1O)OC3' "NK1": 'OC1C[S+]2C(C1O)C(O)CCC2' "NK7": 'NC(=O)c1ccc(cc1)S(=O)(=O)N(C1CNCC1NCc1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)C(F)(F)F' "NKA": 'NCCCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)N)CCSC)CC(C)C)C(C)C)Cc1ccccc1)CO)CC(=O)O)C(O)C)NC(=O)C(Cc1[nH]cnc1)N' "NMDA": 'CNC(C(=O)O)CC(=O)O' "NMM": 'CN1C(=O)C=CC1=O' "NMO": '[O-][N+]1(C)CCOCC1' "NMP": 'CN1C(=O)c2c(C1=O)cccc2' "NMe2": 'CNC' "NMe2 DMS": '' "NMe2-DMS": '' "NMe2.DMS": 'CNC.B' "NMe3": 'CN(C)C' "NMe3 BH3": 'CN(C)C.B' "NMe3.BH3": 'CN(C)C.B' "NMe3BH3": 'CN(C)C.B' "NNAL": 'O=NN(CCCC(c1cccnc1)O)C' "NNK": 'O=NN(CCCC(=O)c1cccnc1)C' "NO2": '[O-]N=O' "NO3": '[O-][N+](=O)[O-]' "NOBA": 'O=Nc1cccc(c1)C(=O)N' "NOC-5": 'NCCCN(N(N=O)O)C(C)C' "NOR": 'NC(C(C(=O)OC(C)C)O)CC1CCCCC1' "NOTA": 'OC(=O)CN1CCN(CCN(CC1)CC(=O)O)CC(=O)O' "NPC": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(cc4c(c3Cn1c2=O)CC)OC(=O)N1CCC(CC1)N' "NPM": 'O=C1C=CC(=O)N1c1ccccc1' "NPO": 'COc1cc[n+](cc1)[O-]' "NPSP": 'O=C1N([Se]c2ccccc2)C(=O)c2c1cccc2' "NPT": 'NCC(C)(C)C' "NTA": 'OC(=O)CN(CC(=O)O)CC(=O)O' "NTD": 'O=C1CCCC(=O)C1=C(c1ccc(cc1[N+](=O)[O-])C(F)(F)F)O' "NVP": 'O=C1Nc2c(C)ccnc2N(c2c1cccn2)C1CC1' "Na": '[Na]' "Na2CO3": '[O-]C(=O)[O-].[Na+].[Na+]' "Na2O2": '[O-][O-].[Na+].[Na+]' "Na2S2O3": '[O-]S(=S)(=O)[O-].[Na+].[Na+]' "Na2S2O4": '[O-]S(=O)S(=O)[O-].[Na+].[Na+]' "Na2S2O5": '[O-]S(=O)S(=O)(=O)[O-].[Na+].[Na+]' "Na2S2O8": '[O-]S(=O)(=O)OOS(=O)(=O)[O-].[Na+].[Na+]' "Na2SO3": '[O-]S(=O)[O-].[Na+].[Na+]' "Na2SO4": '[O-]S(=O)(=O)[O-].[Na+].[Na+]' "NaAsO2": '[O-][As]=O.[Na+]' "NaBF4": 'F[B-](F)(F)F.[Na+]' "NaBH3CN": '[BH3-]C#N.[Na+]' "NaBH4": '[Na+].[BH4-]' "NaBr": '[Na+].[Br-]' "NaBrO3": '[O-][Br](=O)=O.[Na+]' "NaC": 'SCC(C(=O)O)NC(=O)C' "NaCH3S": '[S-]C.[Na+]' "NaCN": '[C-]#N.[Na+]' "NaCNBH3": '[BH3-]C#N.[Na+]' "NaCl": '[Na+].[Cl-]' "NaClO4": '[O-][Cl](=O)(=O)=O.[Na+]' "NaF": '[F-].[Na+]' "NaH": '[H-].[Na+]' "NaHCO3": '[O-]C(=O)O.[Na+]' "NaHF2": '[H+].[F-].[F-].[Na+]' "NaHI2O8": '[O-][I](=O)(=O)=O.[O-][I](=O)(=O)=O.[H+].[Na+]' "NaHS": '[Na+].[SH-]' "NaHSO4": '[O-]S(=O)(=O)O.[Na+]' "NaI": '[Na+].[I-]' "NaIO4": '[O-][I](=O)(=O)=O.[Na+]' "NaMnO4": '[O-][Mn](=O)(=O)=O.[Na+]' "NaN3": '[N-]=[N+]=[N-].[Na+]' "NaNH2": '[Na+].[NH2-]' "NaNO2": '[O-]N=O.[Na+]' "NaNO3": '[O-][N+](=O)[O-].[Na+]' "NaO2": '[O-][O-].[Na+]' "NaOAc": '[O-]C(=O)C.[Na+]' "NaOCl": '[O-]Cl.[Na+]' "NaOEt": '[O-]CC.[Na+]' "NaOH": '[Na+].[OH-]' "NaOMe": '[O-]C.[Na+]' "NaPF6": 'F[P-](F)(F)(F)(F)F.[Na+]' "NaSCH3": '[S-]C.[Na+]' "Nabumetone": 'COc1ccc2c(c1)ccc(c2)CCC(=O)C' "Nafion": 'FC(=C(F)F)OC(C(C(F)(F)F)(OC(C(S(=O)(=O)O)(F)F)(F)F)F)(F)F.FC(=C(F)F)F' "Naloxone": 'C=CCN1CCC23C4(C1Cc1c3c(OC2C(=O)CC4)c(cc1)O)O' "Naltrexone": 'O=C1CCC2(C34C1Oc1c4c(CC2N(CC3)CC2CC2)ccc1O)O' "Naphthyridinone": 'CC(=O)Nc1c2cc(c3ccc(cc3)Cl)c(nc2n(c(=O)c1C(=O)C)C)c1ccc(cc1Cl)Cl' "Naproxen": 'COc1ccc2c(c1)ccc(c2)C(C(=O)O)C' "Naringin": 'OCC1OC(Oc2cc(O)c3c(c2)OC(CC3=O)c2ccc(cc2)O)C(C(C1O)O)OC1OC(C)C(C(C1O)O)O' "Narirutin": 'Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "Nateglinide": 'CC(C1CCC(CC1)C(=O)NC(C(=O)O)Cc1ccccc1)C' "Nb": '[Nb]' "Nd": '[Nd]' "Nd(OH)2": '[Nd].O' "Nec-1": 'S=C1NC(C(=O)N1C)Cc1c[nH]c2c1cccc2' "Neo": 'CC(c1ccccc1)(C[CH]C(c1ccccc1)(C)C)C' "Neodymium": '[Nd]' "Neodymium(III) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Nd+3]' "Neusilin": '[O-][Si]([O-])([O-])[O-].[Mg+2].[Al+3]' "Nevirapine": 'O=C1Nc2c(C)ccnc2N(c2c1cccn2)C1CC1' "Ni": '[Ni]' "NiF2": 'F[Ni]F' "NiO": 'OC(=O)c1cccnc1' "NiO2": '[O-][O-].[Ni+2]' "Nickel": '[Ni]' "Nickel(II) Benzenesulfonate Hexahydrate": '[O-]S(=O)(=O)c1ccccc1.[O-]S(=O)(=O)c1ccccc1.[Ni+2].O.O.O.O.O.O' "Nickel(II) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Ni+2]' "Nickel(II)p-Toluenesulfonate Hexahydrate": 'Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-].[Ni+2].O.O.O.O.O.O' "Niclosamide": 'Clc1ccc(c(c1)C(=O)Nc1ccc(cc1Cl)[N+](=O)[O-])O' "Nicotinamide": 'NC(=O)c1cccnc1' "Nicotine": 'CN1CCCC1c1cccnc1' "Nimodipine": 'COCCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC(C)C)C' "Nitrilotriacetic Acid": 'OC(=O)CN(CC(=O)O)CC(=O)O' "Nle": 'CCCCC(C(=O)O)N' "Nobiletin": 'COc1cc(ccc1OC)c1cc(=O)c2c(o1)c(OC)c(c(c2OC)OC)OC' "Nonivamide": 'CCCCCCCCC(=O)NCc1ccc(c(c1)OC)O' "Norbixin": 'CC(=CC=CC=C(C=CC=C(C=CC(=O)O)C)C)C=CC=C(C=CC(=O)O)C' "Norbornadiene Rhodium(I) Chloride": 'C1=CC2CC1C=C2.[Cl-].[Rh+]' "Norepinephrine": 'NCC(c1ccc(c(c1)O)O)O' "Nornicotine": 'C1CNC(C1)c1cccnc1' "Norswertianolin": 'OCC1OC(Oc2ccc(c3c2c(=O)c2c(o3)cc(cc2O)O)O)C(C(C1O)O)O' "Nortriptyline": 'CNCCC=C1c2ccccc2CCc2c1cccc2' "Novobiocin": 'COC1C(OC(=O)N)C(O)C(OC1(C)C)Oc1ccc2c(c1C)oc(=O)c(c2O)NC(=O)c1ccc(c(c1)CC=C(C)C)O' "Nutlin-3": 'COc1ccc(c(c1)OC(C)C)C1=NC(C(N1C(=O)N1CCNC(=O)C1)c1ccc(cc1)Cl)c1ccc(cc1)Cl' "Nva": 'CCCC(C(=O)O)N' "O,O'-Di-2-pyridyl Thiocarbonate": 'S=C(Oc1ccccn1)Oc1ccccn1' "O-(3,4-Dihydro-4-oxo-1,2,3-benzotriazin-3-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[O+]n1nnc2c(c1=O)cccc2)N(C)C)C' "O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN(C(=[O+]n1nnc2c1cc(Cl)cc2)N(C)C)C' "O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[O+]n1nnc2c1cc(Cl)cc2)N(C)C)C' "O-(7-Azabenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN(C(=[O+]n1nnc2c1nccc2)N(C)C)C' "O-(7-Azabenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[O+]n1nnc2c1nccc2)N(C)C)C' "O-(Benzotriazol-1-yl)-N,N,N',N'-bis(pentamethylene)uronium Hexafluorophosphate": 'C1CCN(CC1)C(=[N+]1CCCCC1)On1nnc2c1cccc2.F[P-](F)(F)(F)(F)F' "O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CN(C(=[O+]n1nnc2c1cccc2)N(C)C)C' "O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[O+]n1nnc2c1cccc2)N(C)C)C' "O-O": 'OO' "O-TBDPS-D-Thr-N-Boc-L-tert-Leu-Diphenylphosphine": 'O=C(OC(C)(C)C)N[C@@H](C(C)(C)C)C(=O)N[C@H]([C@@H](O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)C)CP(c1ccccc1)c1ccccc1' "O-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetramethyluronium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCOC(=O)/C(=N/[O+]=C(N(C)C)N(C)C)/C#N' "O-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetramethyluronium Tetrafluoroborate": 'F[B-](F)(F)F.CCOC(=O)/C(=N/[O+]=C(N(C)C)N(C)C)/C#N' "O-[2-Oxo-1(2H)-pyridyl]-N,N,N',N'-tetramethyluronium Tetrafluoroborate": 'F[B-](F)(F)F.CN(C(=[O+]n1ccccc1=O)N(C)C)C' "O-desmethylangolensin": 'Oc1ccc(cc1)C(C(=O)c1ccc(cc1O)O)C' "O-tert-Butyl-L-threonine": 'C[C@H]([C@@H](C(=O)O)N)OC(C)(C)C' "O2": 'O=O' "O3": '[O-][O+]=O' "O6": 'CCCCCCCCOCCCCC(=O)O' "OAM": 'Cc1nnc(n1CCCn1ccnc1)c1cnn(c1N)C' "OBHA": 'NOCc1ccccc1.Cl' "OBT": 'CCCCCCCCOc1ccc(cc1)/C=N/c1ccc(cc1)C' "OCBN": 'N#Cc1ccccc1Cl' "OCS": 'OC(=O)C(CS(=O)(=O)O)N' "OCT": 'Cc1ccccc1Cl' "OD": '[OH]' "ODPA": 'O=C1OC(=O)c2c1cc(cc2)Oc1ccc2c(c1)C(=O)OC2=O' "ODQ": 'O=c1onc2n1c1ccccc1nc2' "OF2": 'FOF' "OFLX": 'CN1CCN(CC1)c1c(F)cc2c3c1OCC(n3cc(c2=O)C(=O)O)C' "OH": '[OH-]' "OHCO": 'OC=O' "OHN": 'CCCCCCCCCC(=O)CC(=O)NC1CCOC1=O' "OKA": 'CC1=CC2(OC(C1)C(C=CC1CCC3(O1)CCC1C(O3)C(O)C(=C)C(O1)C(CC(C1OC3(CCCCO3)CCC1C)C)O)C)OC(CCC2O)CC(C(=O)O)(O)C' "OLL": 'CCCCCCCCC=CCCCCCCCC(=O)OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COC(=O)CCCCCCCC=CCC=CCCCCC' "OMC": 'COC1C(O)C(OC1n1ccc(nc1=O)N)COP(=O)(O)O' "OMe": 'CO' "OMe2": 'COC' "ONOO-": '[O-]ON=O' "ONPG": 'OCC1OC(Oc2ccccc2[N+](=O)[O-])C(C(C1O)O)O' "OOBA": 'CCCCCCCCc1ccc(cc1)C(=O)O' "OOO": 'CCOC(=O)C(NC1CCC(CC1)n1cc(c2c1ncnc2N)c1ccc(cc1)Oc1ccccc1)CC(C)C' "OPE": 'NCCOP(=O)(O)O' "ORO": 'O=c1[nH]c(=O)[nH]c(c1)C(=O)O' "OSu": '[O]N1C(=O)CCC1=O' "OTs": 'NCC(c1ccc(cc1)O)O' "OXO": 'O' "Obidoxime": 'O=[NH+]C=C1C=CN(C=C1)COCN1C=CC(=C[NH+]=O)C=C1' "Octadecamethylcyclononasiloxane": 'C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C' "Octadecyltriethoxysilane": 'CCCCCCCCCCCCCCCCCC[Si](OCC)(OCC)OCC' "Octadecyltrimethoxysilane": 'CCCCCCCCCCCCCCCCCC[Si](OC)(OC)OC' "Octakis(dimethylsilyloxy)octasilsesquioxane": 'C[SiH](O[Si]12O[Si]3(O[SiH](C)C)O[Si]4(O[Si](O2)(O[SiH](C)C)O[Si]2(O[Si](O1)(O[SiH](C)C)O[Si](O3)(O[SiH](C)C)O[Si](O4)(O2)O[SiH](C)C)O[SiH](C)C)O[SiH](C)C)C' "Octamethylcyclotetrasiloxane": 'C[Si]1(C)O[Si](C)(C)O[Si](O[Si](O1)(C)C)(C)C' "Octamethyltrisiloxane": 'C[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C' "Octaphenylcyclotetrasiloxane": 'c1ccc(cc1)[Si]1(O[Si](O[Si](O[Si](O1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1' "Octaphenyloctasilsesquioxane": 'c1ccc(cc1)[Si]12O[Si]3(O[Si]4(O[Si](O2)(O[Si]2(O[Si](O1)(O[Si](O3)(O[Si](O4)(O2)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1' "Octopamine": 'NCC(c1ccc(cc1)O)O' "Octylphenol": 'CCCCCCCCc1ccccc1O' "Oil-Red-O": 'Cc1ccc(c(c1)N=Nc1cc(C)c(cc1C)NN=C1C(=O)C=Cc2c1cccc2)C' "Olanzapine": 'CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C' "Oleandrin": 'COC1CC(OC2CCC3(C(C2)CCC2C3CCC3(C2(O)CC(C3C2=CC(=O)OC2)OC(=O)C)C)C)OC(C1O)C' "Omeprazole": 'COc1ccc2c(c1)[nH]c(n2)S(=O)Cc1ncc(c(c1C)OC)C' "Orlistat": 'CCCCCCCCCCCC(CC1OC(=O)C1CCCCCC)OC(=O)C(CC(C)C)NC=O' "Ornidazole": 'ClCC(Cn1c(C)ncc1[N+](=O)[O-])O' "Os": '[Os]' "OsO4": '[O-2].[O-2].[O-2].[O-2].[Os+8]' "Oseltamivir": 'CCOC(=O)C1=CC(C(C(C1)N)NC(=O)C)OC(CC)CC' "Osmium": '[Os]' "Osmium Tetroxide (4% in Water)": '[O-2].[O-2].[O-2].[O-2].[Os+8]' "Ospemifene": 'ClCCC(=C(c1ccccc1)c1ccc(cc1)OCCO)c1ccccc1' "Osphena": 'ClCCC(=C(c1ccccc1)c1ccc(cc1)OCCO)c1ccccc1' "Oxalyl Chloride": 'ClC(=O)C(=O)Cl' "Oxalylchlorid": 'ClC(=O)C(=O)Cl' "Oxalylchloride": 'ClC(=O)C(=O)Cl' "Oxycodone": 'COc1ccc2c3c1OC1C43CCN(C(C2)C4(O)CCC1=O)C' "Oxymatrine": 'O=C1CCCC2N1CC1CCC[N+]3(C1C2CCC3)[O-]' "Oxysporone": 'O=C1OC2C(C1)C(O)C=CO2' "Oxytocin": 'CCC(C1NC(=O)C(Cc2ccc(cc2)O)NC(=O)C(N)CSSCC(NC(=O)C(NC(=O)C(NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCCC1C(=O)NC(C(=O)NCC(=O)N)CC(C)C)C' "Ozone": '[O-][O+]=O' "P(o-tol)3": 'Cc1ccccc1P(c1ccccc1C)c1ccccc1C' "P(otol)3": 'Cc1ccccc1P(c1ccccc1C)c1ccccc1C' "P2O5": 'O=P12OP3(=O)OP(=O)(O2)OP(=O)(O1)O3' "PAA": 'COc1ccc(cc1)/N=[N+](/c1ccc(cc1)OC)\[O-]' "PAAm": 'ClCCN(c1ccc(cc1)CC(=O)O)CCCl' "PAB": 'OC(=O)c1ccc(cc1)N' "PABA": 'OC(=O)c1ccc(cc1)N' "PACA": 'ONC(=O)c1ncc2c(c1)c1ccccc1n2Cc1ccc(cc1)F' "PAH": 'O=C(c1ccc(cc1)N)NCC(=O)O' "PAL": 'OC(=O)[C@@H](Nc1cccnc1)C' "PAMP": 'C(CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1' "PAP": 'CCOc1ccc(cc1)/N=[N+](/c1ccc(cc1)OCC)\[O-]' "PAPS": 'OC1C(OP(=O)(O)O)C(OC1n1cnc2c1ncnc2N)COP(=O)(OS(=O)(=O)O)O' "PAR": 'OC1CC(O)C(OC1C)O' "PAT": 'Nc1nnnn1c1ccccc1' "PBD": 'c1ccc(cc1)c1ccc(cc1)c1nnc(o1)c1ccccc1' "PBDE-47": 'Brc1ccc(c(c1)Br)Oc1ccc(cc1Br)Br' "PBDE-99": 'Brc1ccc(c(c1)Br)Oc1cc(Br)c(cc1Br)Br' "PBH": 'CC(C(O)(C)C)(O)C.B' "PBHA": 'ON(C(=O)c1ccccc1)c1ccccc1' "PBQ": 'O=C1C=CC(=O)C=C1' "PBr3": 'BrP(Br)Br' "PCA": 'Nc1ccc(cc1)Cl' "PCB-153": 'Clc1cc(Cl)c(cc1c1cc(Cl)c(cc1Cl)Cl)Cl' "PCB126": 'Clc1ccc(cc1Cl)c1cc(Cl)c(c(c1)Cl)Cl' "PCB153": 'Clc1cc(Cl)c(cc1c1cc(Cl)c(cc1Cl)Cl)Cl' "PCBM": 'COC(=O)CCCC1(c2ccccc2)C23C41c1c5c2c2c6c7c5c5c8c1c1c9c4c4c%10c3c3c2c2c6c6c%11c7c5c5c7c8c1c1c8c9c4c4c9c%10c3c3c2c2c6c6c%11c5c5c7c1c1c8c4c4c9c3c2c2c4c1c5c62' "PCBs": 'Clc1ccc(cc1)OS(=O)(=O)c1ccccc1' "PCC": 'c1ccc[nH+]c1.[O-][Cr](=O)(=O)Cl' "PCN": 'N#CC1CC2C(C1C(=O)C)(C)CCC1C2CC=C2C1(C)CCC(C2)O' "PCP": 'C1CCC(CC1)(N1CCCCC1)c1ccccc1' "PCPA": 'OC(=O)COc1ccc(cc1)Cl' "PCl3": 'ClP(Cl)Cl' "PCl5": 'ClP(Cl)(Cl)(Cl)Cl' "PDB": 'Clc1ccc(cc1)Cl' "PDC": 'c1ccc[nH+]c1.c1ccc[nH+]c1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]' "PDMS": 'C[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C' "PDN": 'OC=C(C1(O)CCC2C1(C)CC(=O)C1C2CCC2=CC(=O)C=CC12C)O' "PDO": 'OCCCO' "PDS": 'c1ccc(nc1)SSc1ccccn1' "PDT": 'CN(N=Nc1ccccc1)C' "PEA": 'CC(c1ccccc1)N' "PEEG": 'Nc1nc(=O)c2c([nH]1)n(CCOCCP(=O)(O)O)cn2' "PEG": 'OCCO' "PEG-DMA": 'O=C(C(=C)C)OCCOC(=O)C(=C)C' "PEG12": 'OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO' "PEG400": 'OCCOCCOCCOCCOCCO' "PEHA": 'NCCNCCNCCNCCNCCN' "PEITC": 'S=C=NCCc1ccccc1' "PEMA": 'CCC(c1ccccc1)(C(=O)N)C(=O)N' "PEO": 'OO' "PEPA": 'NC(=O)COc1c(F)cc(cc1F)SCCNS(=O)(=O)c1ccccc1' "PET": 'NC(=N)c1ccc(cc1)OCCOCCOc1ccc(cc1)C(=N)N' "PF3": 'FP(F)F' "PFA": 'O=COC(=O)C(C)(C)C' "PFAA": 'O=C(C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F' "PFB": 'OCc1c(F)c(F)c(c(c1F)F)F' "PFBM": 'NC(=O)C(C(C(F)(F)F)(F)F)(F)F' "PFDA": 'OC(=O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F' "PFHxS": 'FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F' "PFM": 'NC(=O)C(C(C(F)(F)F)(F)F)(F)F' "PFOA": 'OC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F' "PFOS": 'FC(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F' "PFOSA": 'FC(C(C(C(C(S(=O)(=O)N)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F' "PFPA": 'O=C(C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F' "PGD2": 'CCCCCC(C=CC1C(=O)CC(C1CC=CCCCC(=O)O)O)O' "PGE2": 'CCCCCC(C=CC1C(O)CC(=O)C1CC=CCCCC(=O)O)O' "PGG": 'O=C(NCC(=O)O)CCCP(=O)(Oc1ccc(cc1)[N+](=O)[O-])O' "PH": 'c1ccc2c(c1)c1ccccc1cc2' "PHE": 'NC(C(=O)O)Cc1ccccc1' "PHEMA": 'CC(=C)C(=O)OCCO' "PHH": 'O=C1OCc2c1c(Cl)c(Cl)c(c2Cl)Cl' "PHTPP": 'Oc1ccc(cc1)c1c(nn2c1nc(cc2C(F)(F)F)C(F)(F)F)c1ccccc1' "PID": 'CC(=O)O[I](c1ccccc1)OC(=O)C' "PIDA": 'CC(=O)O[I](c1ccccc1)OC(=O)C' "PIFA": 'Ic1cccc(c1OC(=O)C(F)(F)F)OC(=O)C(F)(F)F' "PILO": 'CCC1C(=O)OCC1Cc1cncn1C.Cl' "PINO": '[O]N1C(=O)c2c(C1=O)cccc2' "PLLA": 'OC(=O)C(O)C' "PLP": 'O=Cc1c(COP(=O)(O)O)cnc(c1O)C' "PMDS": 'C[SiH](O[Si](C)(C)C)C' "PMDTA": 'CN(CCN(C)C)CCN(C)C' "PMO": 'COc1ccc2c(c1)ncn2C1OC(C(C1O)O)COP(=O)(O)O' "PMSF": 'FS(=O)(=O)Cc1ccccc1' "PMe3": 'CP(C)C' "PNAH": 'CCCN1C=CCC(=C1)C(=O)N' "PNB": '[O-]C(=O)c1ccc(cc1)[N+](=O)[O-]' "PO4": '[O-]P(=O)([O-])[O-]' "POCl3": 'ClP(=O)(Cl)Cl' "POO": 'CN1CCCC(C1)CN(C(=O)Cn1c(c2ccccc2)c(c2c1cc(cc2)C(=O)O)C1CCCCC1)C' "POPC": 'CCCCCCCCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(OCC[N+](C)(C)C)[O-]' "PP2": 'Clc1ccc(cc1)c1nn(c2c1c(N)ncn2)C(C)(C)C' "PPA": 'o1op2op1oo2.OP(=O)(O)O' "PPCA": 'OC1C(CCP(=O)(OP(=O)(O)O)O)OC(C1O)n1cnc2c1ncnc2N' "PPF": 'c1ccc(cc1)c1ccc(o1)c1ccccc1' "PPG-5-CETETH-20": 'O1CC1.CC1CO1.CCCCCCCCCCCCCCCCO' "PPI": 'c1ccc(cc1)C1(NCCN1)c1ccccn1' "PPO": 'c1ccc(cc1)c1ncc(o1)c1ccccc1' "PPSE": 'C[Si](OP(=O)=O)(C)C' "PPT": 'CCCC1=C(c2ccc(cc2)O)N(NC1=C1C=CC(=O)C=C1)c1ccc(cc1)O' "PPTS": 'c1ccc[nH+]c1.Cc1ccc(cc1)S(=O)(=O)[O-]' "PPY": 'C1CCN(C1)c1ccncc1' "PPh3": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1' "PPy": 'O=C(C(=O)O)Cc1ccccc1' "PQQ": 'OC(=O)c1cc(nc2c1-c1[nH]c(cc1C(=O)C2=O)C(=O)O)C(=O)O' "PRPA": 'CCCP(=O)(OP(=O)(CCC)O)O' "PRZ": 'COc1nccnc1CC(C)C' "PSA": 'O[PH2]=O' "PSM": 'CSCCC(C(=O)NCc1ccc(cc1)C(=N)N)NC(=O)C(C(O)C)NS(=O)(=O)CCC' "PSQ": 'OC(=O)C(CCCNP(=O)(NS(=O)(=O)O)N)N' "PSS": 'CCNC(Cc1ccccc1)C=O' "PTAB": 'C[N+](c1ccccc1)(C)C.[Br-].[Br-].[Br-]' "PTAD": 'O=C1N=NC(=O)N1c1ccccc1' "PTCCl": 'ClC(=S)Oc1ccccc1' "PTCDA": 'O=C1OC(=O)c2c3c1ccc1c3c(cc2)c2c3c1ccc1c3c(cc2)C(=O)OC1=O' "PTFE": '[H]' "PTSA": 'Cc1ccc(cc1)S(=O)(=O)O' "PTZ": 'C1CCn2c(CC1)nnn2' "PUA": 'O=c1ccn(c(=O)[nH]1)C1CC(C(O1)COP(=O)(O)O)OP(=O)(OP(=O)(OCC1OC(C(C1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O' "PVA": 'OC=C' "PVDF": 'FC(=C)F' "PVO": 'O=C(NC(C1NC(C(S1)(C)C)C(=O)O)C(=O)O)COc1ccccc1' "PVP": 'C=CN1CCCC1=O' "PZQ": 'O=C(N1CC(=O)N2C(C1)c1ccccc1CC2)C1CCCCC1' "PZT": '[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Zr+4].[Pb+2]' "Paeoniflorin": 'OCC1OC(OC23CC4C3(COC(=O)c3ccccc3)C3OC2(C)CC4(O3)O)C(C(C1O)O)O' "Paeonol": 'COc1ccc(c(c1)O)C(=O)C' "Palbinone": 'O=C1C(=C2C(C1=O)(C)C1(C)CCC3C(C1C=C2)(C)CCC(C3(C)C)O)O' "Paliperidone": 'Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2O' "Palladium Carbon": '[Pd]' "Palladium Hydroxide": '[Pd+2].[OH-].[OH-]' "Palladium(II) Acetate": '[O-]C(=O)C.[O-]C(=O)C.[Pd+2]' "Palladium(II) Chloride": '[Cl-].[Cl-].[Pd+2]' "Palladium(II) Trifluoroacetate": '[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[Pd+2]' "Palmitate": 'CCCCCCCCCCCCCCCC(=O)O' "Palmitic Acid": 'CCCCCCCCCCCCCCCC(=O)O' "Palonosetron": 'O=C1N(CC2c3c1cccc3CCC2)C1CN2CCC1CC2' "Panaxadiol": 'OC1CC2C3(C)CCC(C(C3CCC2(C2(C1C(CC2)C1(C)CCCC(O1)(C)C)C)C)(C)C)O' "Paracetamol": 'CC(=O)Nc1ccc(cc1)O' "Paraquat": 'C[n+]1ccc(cc1)c1cc[n+](cc1)C' "Paricalcitol": 'OC1CC(O)CC(=CC=C2CCCC3(C2CCC3C(C=CC(C(O)(C)C)C)C)C)C1' "Paroxetine": 'Fc1ccc(cc1)C1CCNCC1COc1ccc2c(c1)OCO2' "Pasireotide": 'NCCCCC1NC(=O)C(NC(=O)C(NC(=O)C2N(C(=O)C(NC(=O)C(NC1=O)Cc1ccc(cc1)OCc1ccccc1)Cc1ccccc1)CC(C2)OC(=O)NCCN)c1ccccc1)Cc1c[nH]c2c1cccc2' "Pazopanib": 'CN(c1ccc2c(c1)nn(c2C)C)c1ccnc(n1)Nc1ccc(c(c1)S(=O)(=O)N)C' "PbSe": '[Se]=[Pb]' "PbTe": '[Te]=[Pb]' "Pd": '[Pd]' "Pd(OAc)2": '[O-]C(=O)C.[O-]C(=O)C.[Pd+2]' "Pd(OH)2": '[Pd+2].[OH-].[OH-]' "Pd(PPh3)2Cl2": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.Cl[Pd]Cl' "Pd(PPh3)4": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Pd]' "Pd(dppf)Cl2": 'c1ccc(cc1)P(c1ccccc1)C1=CC(C=C1)[Fe]C1C=CC(=C1)P(c1ccccc1)c1ccccc1.Cl[Pd]Cl.ClCCl' "Pd-C": 'Pd' "Pd/C": 'Pd' "Pd2(dba)3": 'O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.[Pd].[Pd]' "PdCl2": '[Cl-].[Cl-].[Pd+2]' "PdCl2(PPh3)2": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.Cl[Pd]Cl' "Pel": 'CCCCCCCC[C]=O' "Penconazole": 'CCCC(c1ccc(cc1Cl)Cl)Cn1cncn1' "Pentadecylmagnesium Bromide": 'CCCCCCCCCCCCCCC[Mg]Br' "Pentafluoroanilinium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.Fc1cccc(c1F)[N+](F)(F)F' "Pentafluorobenzoyl Chloride": 'Fc1c(F)c(C(=O)Cl)c(c(c1F)F)F' "Pentafluorophenol": 'Fc1c(O)c(F)c(c(c1F)F)F' "Pentafluorophenyl 4-Nitrobenzenesulfonate": '[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Oc1c(F)c(F)c(c(c1F)F)F' "Pentafluorophenyl Trifluoroacetate": 'O=C(C(F)(F)F)Oc1c(F)c(F)c(c(c1F)F)F' "Pentafluoropropionic Anhydride": 'O=C(C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F' "Pentosidine": 'NC(C(=O)O)CCCCn1cccc2-c1nc(n2)NCCCC(C(=O)O)N' "Pentylboronic Acid": 'CCCCCB(O)O' "Pentylmagnesium Bromide": 'CCCCC[Mg]Br' "Pentyltriethoxysilane": 'CCCCC[Si](OCC)(OCC)OCC' "Peramivir": 'CCC(C(C1C(N=C(N)N)CC(C1O)C(=O)O)NC(=O)C)CC' "Perampanel": 'N#Cc1ccccc1c1cc(cn(c1=O)c1ccccc1)c1ccccn1' "Permethrin": 'ClC(=CC1C(C1(C)C)C(=O)OCc1cccc(c1)Oc1ccccc1)Cl' "Perylene": 'c1cc2cccc3c2c(c1)c1cccc2c1c3ccc2' "Pet": '[CH2]Cc1ccccn1' "PhIP": 'Cn1c(N)nc2c1cc(cn2)c1ccccc1' "PhMe": 'Cc1ccccc1' "PhSeH": '[Se]c1ccccc1' "PhSiH3": '[SiH3]c1ccccc1' "Phe": 'N[C@H](C(=O)O)Cc1ccccc1' "Phen": 'c1ccc2c(n1)c1ncccc1cc2' "Phenacetin": 'CCOc1ccc(cc1)NC(=O)C' "Phenanthroline": 'c1ccc2c(n1)c1ncccc1cc2' "Phencyclidine": 'C1CCC(CC1)(N1CCCCC1)c1ccccc1' "Phenformin": 'NC(=NCCc1ccccc1)N=C(N)N' "PhenoFluor Mix": 'CC(c1cccc(c1N1C=C[N](=[C+]1Cl)c1c(cccc1C(C)C)C(C)C)C(C)C)C.F[Cs].[Cl-]' "Phenobarbital": 'CCC1(C(=O)NC(=O)NC1=O)c1ccccc1' "Phenyl Trifluoromethyl Sulfone": 'FC(S(=O)(=O)c1ccccc1)(F)F' "Phenyl Trifluoromethyl Sulfoxide": 'FC(S(=O)c1ccccc1)(F)F' "Phenylarsine Oxide": 'O=[As]c1ccccc1' "Phenylarsonic Acid": 'O[As](=O)(c1ccccc1)O' "Phenylgermanium Trichloride": 'Cl[Ge](c1ccccc1)(Cl)Cl' "Phenylmagnesium Bromide": 'Br[Mg]c1ccccc1' "Phenylmagnesium Chloride": 'Cl[Mg]c1ccccc1' "Phenylmagnesium Iodide": 'I[Mg]c1ccccc1' "Phenylphosphonic Dichloride": 'ClP(=O)(c1ccccc1)Cl' "Phenylsilane": '[SiH3]c1ccccc1' "Phenyltin Trichloride": 'Cl[Sn](c1ccccc1)(Cl)Cl' "Phenytoin": 'O=C1NC(=O)NC1(c1ccccc1)c1ccccc1' "Phosphomolybdic Acid Ethanol Solution": 'OP(=O)(O[Mo](=O)(=O)O)O.CCO' "Phosphomolybdic Acid Hydrate": 'OP(=O)(O[Mo](=O)(=O)O)O.O' "Phthalazinone": 'O=c1[nH]ncc2c1cccc2' "Phthalic Acid": 'OC(=O)c1ccccc1C(=O)O' "Phthalide": 'O=C1OCc2c1cccc2' "Phthalocyanine": 'c1ccc2c(c1)C1=NC2=Nc2[nH]c(c3c2cccc3)N=C2N=C(N=c3[nH]c(=N1)c1ccccc31)c1c2cccc1' "Phthalocyanine (purified by sublimation)": 'c1ccc2c(c1)C1=NC2=Nc2[nH]c(c3c2cccc3)N=C2N=C(N=c3[nH]c(=N1)c1ccccc31)c1c2cccc1' "Phyllanthin": 'COCC(C(Cc1ccc(c(c1)OC)OC)COC)Cc1ccc(c(c1)OC)OC' "Phyllocontin": 'Cn1c(=O)n(C)c2c(c1=O)[nH]cn2.Cn1c(=O)n(C)c2c(c1=O)[nH]cn2.NCCN' "Phyllostin": 'COC(=O)C1=CC(C2C(C1)OC(C)C(=O)O2)O' "Piceatannol": 'Oc1cc(C=Cc2ccc(c(c2)O)O)cc(c1)O' "Pilocarpine": 'CCC1C(=O)OCC1Cc1cncn1C' "Pinosylvin": 'Oc1cc(C=Cc2ccccc2)cc(c1)O' "Pioglitazone": 'CCc1ccc(nc1)CCOc1ccc(cc1)CC1SC(=O)NC1=O' "Piperine": 'O=C(N1CCCCC1)C=CC=Cc1ccc2c(c1)OCO2' "Piplartine": 'COc1cc(C=CC(=O)N2CCC=CC2=O)cc(c1OC)OC' "Pirimicarb": 'CN(C(=O)Oc1nc(nc(c1C)C)N(C)C)C' "Platinum": '[Pt]' "Platinum(IV) Oxide": '[O-2].[O-2].[Pt+4]' "Plu": 'NC(P(=O)(O)O)CC(C)C' "Podocarpane": 'CC1(C)CCCC2(C1CCC1C2CCCC1)C' "Poloxamer": 'O1CC1.CC1CO1' "Polydatin": 'OCC1OC(Oc2cc(C=Cc3ccc(cc3)O)cc(c2)O)C(C(C1O)O)O' "Pomalidomide": 'O=C1CCC(C(=O)N1)N1C(=O)c2c(C1=O)c(N)ccc2' "Pomalyst": 'O=C1CCC(C(=O)N1)N1C(=O)c2c(C1=O)c(N)ccc2' "Posaconazole": 'CCC(n1ncn(c1=O)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)OCC1COC(C1)(Cn1cncn1)c1ccc(cc1F)F)C(O)C' "Potassium (2-Formylphenyl)trifluoroborate": 'O=Cc1ccccc1[B-](F)(F)F.[K+]' "Potassium (2-Methoxyphenyl)trifluoroborate": 'COc1ccccc1[B-](F)(F)F.[K+]' "Potassium (3-Cyanophenyl)trifluoroborate": 'N#Cc1cccc(c1)[B-](F)(F)F.[K+]' "Potassium (3-Methoxyphenyl)trifluoroborate": 'COc1cccc(c1)[B-](F)(F)F.[K+]' "Potassium (3-Nitrophenyl)trifluoroborate": '[O-][N+](=O)c1cccc(c1)[B-](F)(F)F.[K+]' "Potassium (4-Cyanophenyl)trifluoroborate": 'N#Cc1ccc(cc1)[B-](F)(F)F.[K+]' "Potassium (4-Methoxyphenyl)trifluoroborate": 'COc1ccc(cc1)[B-](F)(F)F.[K+]' "Potassium (Acetoxymethyl)trifluoroborate": 'F[B-](COC(=O)C)(F)F.[K+]' "Potassium (Bromomethyl)trifluoroborate": 'F[B-](CBr)(F)F.[K+]' "Potassium (Iodomethyl)trifluoroborate": 'F[B-](CI)(F)F.[K+]' "Potassium (Methoxymethyl)trifluoroborate": 'F[B-](COC)(F)F.[K+]' "Potassium 2-Thienyltrifluoroborate": 'F[B-](c1cccs1)(F)F.[K+]' "Potassium 3-Pyridyltrifluoroborate": 'F[B-](c1cccnc1)(F)F.[K+]' "Potassium 4-Pyridyltrifluoroborate": 'F[B-](c1ccncc1)(F)F.[K+]' "Potassium Allyltrifluoroborate": 'F[B-](CC=C)(F)F.[K+]' "Potassium Bis(1-pyrazolyl)borohydride": 'c1cnn(c1)[BH2-]n1cccn1.[K+]' "Potassium Bis(trimethylsilyl)amide": 'C[Si]([N-][Si](C)(C)C)(C)C.[K+]' "Potassium Borohydride": '[K+].[BH4-]' "Potassium Cyclopropyltrifluoroborate": 'F[B-](C1CC1)(F)F.[K+]' "Potassium Hexafluoroarsenate": 'F[As-](F)(F)(F)(F)F.[K+]' "Potassium Perrhenate": '[O-][Re](=O)(=O)=O.[K+]' "Potassium Phenyltrifluoroborate": 'F[B-](c1ccccc1)(F)F.[K+]' "Potassium Trifluoro(trifluoromethyl)borate": 'FC([B-](F)(F)F)(F)F.[K+]' "Potassium Trifluoroacetate": '[O-]C(=O)C(F)(F)F.[K+]' "Potassium Trimethoxy(trifluoromethyl)borate": 'CO[B-](C(F)(F)F)(OC)OC.[K+]' "Potassium Tris(1-pyrazolyl)borohydride": 'c1cnn(c1)[BH-](n1cccn1)n1cccn1.[K+]' "Potassium Vinyltrifluoroborate": 'F[B-](C=C)(F)F.[K+]' "Potassium [[(tert-Butoxycarbonyl)amino]methyl]trifluoroborate": 'F[B-](CNC(=O)OC(C)(C)C)(F)F.[K+]' "Potassiumo-Tolyltrifluoroborate": 'Cc1ccccc1[B-](F)(F)F.[K+]' "Potassiump-Tolyltrifluoroborate": 'F[B-](c1ccc(cc1)C)(F)F.[K+]' "Potassiumtert-Butoxide": '[O-]C(C)(C)C.[K+]' "Potassiumtert-Pentoxide": 'CCC(C)(C)[O-].[K+]' "Ppy": 'O=C(C(=O)O)Cc1ccccc1' "PrOH": 'CCCO' "Pranlukast": 'O=C(c1ccc(cc1)OCCCCc1ccccc1)Nc1cccc2c1oc(cc2=O)c1nn[nH]n1' "Prasugrel": 'CC(=O)Oc1sc2c(c1)CN(CC2)C(c1ccccc1F)C(=O)C1CC1' "Pravastatin": 'CCC(C(=O)OC1CC(O)C=C2C1C(CCC(CC(CC(=O)O)O)O)C(C=C2)C)C' "Praziquantel": 'O=C(N1CC(=O)N2C(C1)c1ccccc1CC2)C1CCCCC1' "Prednisolone": 'OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)C=CC12C' "Pregabalin": 'NCC(CC(=O)O)CC(C)C' "Pregnane": 'CCC1CCC2C1(C)CCC1C2CCC2C1(C)CCCC2' "Prilocaine": 'CCCNC(C(=O)Nc1ccccc1C)C' "Primperan": 'CCN(CCNC(=O)c1cc(Cl)c(cc1OC)N)CC' "Pristimerin": 'COC(=O)C1(C)CCC2(C(C1)C1(C)CCC3(C(=CC=C4C3=CC(=O)C(=C4C)O)C1(CC2)C)C)C' "Pro": 'OC(=O)[C@@H]1CCCN1' "Probucol": 'CC(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C' "Procyclidine": 'OC(c1ccccc1)(C1CCCCC1)CCN1CCCC1' "Procymidone": 'O=C1N(c2cc(Cl)cc(c2)Cl)C(=O)C2(C1(C)C2)C' "Prodan": 'CCC(=O)c1ccc2c(c1)ccc(c2)N(C)C' "Profenofos": 'CCCSP(=O)(Oc1ccc(cc1Cl)Br)OCC' "Progesterone": 'O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2C(=O)C)C)C' "Propanil": 'CCC(=O)Nc1ccc(c(c1)Cl)Cl' "Propionic Acid": 'CCC(=O)O' "Propofol": 'CC(c1cccc(c1O)C(C)C)C' "Propranolol": 'OC(COc1cccc2c1cccc2)CNC(C)C' "Propylboronic Acid": 'CCCB(O)O' "Propylmagnesium Bromide": 'CCC[Mg]Br' "Prunetin": 'COc1cc(O)c2c(c1)occ(c2=O)c1ccc(cc1)O' "Psoralen": 'O=c1ccc2c(o1)cc1c(c2)cco1' "Pt": '[Pt]' "PtO2": '[O-2].[O-2].[Pt+4]' "PtTFPP": 'Fc1c(F)c(C2=C3C=CC(=N3)C(=c3ccc(=C(C4=NC(=C(c5[n-]c2cc5)c2c(F)c(F)c(c(c2F)F)F)C=C4)c2c(F)c(F)c(c(c2F)F)F)[n-]3)c2c(F)c(F)c(c(c2F)F)F)c(c(c1F)F)F.[Pt+2]' "Pterostilbene": 'COc1cc(C=Cc2ccc(cc2)O)cc(c1)OC' "Puerarin": 'OCC1OC(C(C(C1O)O)O)c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O' "Purine": 'c1ncc2c(n1)nc[nH]2' "Putrescine": 'NCCCCN' "Pv": 'O=[C]C(C)(C)C' "Py": 'c1cccnc1' "Py.BH3": 'c1cccnc1.B' "PyBOP": 'C1CCN(C1)[P+](N1CCCC1)(N1CCCC1)On1nnc2c1cccc2.F[P-](F)(F)(F)(F)F' "Pyca": '[O-]C(=O)c1ccccn1' "Pyr": 'c1cccnc1' "Pyridine - Sulfur Trioxide Complex": 'c1cccnc1.O=S(=O)=O' "Pyridine BH3": 'c1cccnc1.B' "Pyridine Iodine Monochloride": 'Clc1cccnc1I' "Pyridine-2-sulfonyl Fluoride": 'FS(=O)(=O)c1ccccn1' "Pyridine-BH3": 'c1cccnc1.B' "Pyridinium 3-Nitrobenzenesulfonate": 'c1ccc[nH+]c1.[O-][N+](=O)c1cccc(c1)S(=O)(=O)[O-]' "Pyridinium Bromide Perbromide": 'c1ccc[nH+]c1.BrBr.[Br-]' "Pyridinium Chlorochromate": 'c1ccc[nH+]c1.[O-][Cr](=O)(=O)Cl' "Pyridinium Dichromate": 'c1ccc[nH+]c1.c1ccc[nH+]c1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]' "Pyridinium Fluorochromate": 'c1ccc[nH+]c1.[O-][Cr](=O)(=O)F' "Pyridiniump-Toluenesulfonate": 'c1ccc[nH+]c1.Cc1ccc(cc1)S(=O)(=O)[O-]' "Pyrimidine-2-sulfonyl Fluoride": 'FS(=O)(=O)c1ncccn1' "Pyrogallol": 'Oc1c(O)cccc1O' "Pyruvate": 'CC(=O)C(=O)[O-]' "QDC": 'c1ccc2c(c1)[nH+]ccc2.c1ccc2c(c1)[nH+]ccc2.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]' "QNO": '[O-][n+]1cccc2c1cccc2' "QPB": 'CC[N+]1(C)CCCC(C1)OC(=O)C(c1ccccc1)(c1ccccc1)O.[Br-]' "QUINAP": 'c1ccc(cc1)P(c1ccc2c(c1c1nccc3c1cccc3)cccc2)c1ccccc1' "Qsymia": 'CC(Cc1ccccc1)(N)C.NS(=O)(=O)OCC12OCC3C(C2OC(O1)(C)C)OC(O3)(C)C' "Quartz": 'O=[Si]=O' "Quercetin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O' "Quetiapine": 'OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2' "Quin-C1": 'CCCCOc1ccc(cc1)C(=O)NN1C(Nc2c(C1=O)cccc2)c1ccc(cc1)OC' "Quinacrine": 'CCN(CCCC(Nc1c2cc(OC)ccc2nc2c1ccc(c2)Cl)C)CC' "Quincoridine": 'OC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2C=C' "Quincorine": 'OC[C@@H]1C[C@@H]2CC[N@]1C[C@@H]2C=C' "Quinidine": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1ccnc2c1cc(OC)cc2)O' "Quinidine Sulfate Dihydrate": 'OS(=O)(=O)O.C=C[C@H]1C[N@@]2CC[C@H]1C[C@H]2[C@H](c1ccnc2c1cc(OC)cc2)O.O.O' "Quinine": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1ccnc2c1cc(OC)cc2)O' "Quinine Hydrochloride Dihydrate": 'C=C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2[C@@H](c1ccnc2c1cc(OC)cc2)O.Cl.O.O' "Quinolinium Dichromate": 'c1ccc2c(c1)[nH+]ccc2.c1ccc2c(c1)[nH+]ccc2.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]' "Quinpirole": 'CCCN1CCCC2C1Cc1cn[nH]c1C2' "Quinuclidine": 'C1CN2CCC1CC2' "R-123": 'ClC(C(F)(F)F)Cl' "R-flurbiprofen": 'OC(=O)C(c1ccc(c(c1)F)c1ccccc1)C' "R6G": 'CCOC(=O)c1ccccc1c1c2-c(oc3c1cc(C)c(c3)NCC)cc(=[NH+]CC)c(c2)C.[Cl-]' "RAC": 'O=C(Nc1ccccc1C(=O)N(C)C)OCc1ccc(cc1)C(=O)O' "RAI": 'OCC1(CO)CCC(=O)N1c1ccc(cc1N=C(N)N)C(=O)O' "RAMP": 'COC[C@H]1CCCN1N' "RBV": 'OCC1OC(C(C1O)O)n1cnc(n1)C(=O)N' "RDX": '[O-][N+](=O)N1CN(CN(C1)[N+](=O)[O-])[N+](=O)[O-]' "RENORPHOS": 'C1CC2CC1[C@H]([C@@H]2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1' "RES": 'ONC(=O)C(C(COP(=O)(O)O)O)O' "RFRP-3": 'CC(CC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N)Cc1ccccc1)CCCN=C(N)N)CCC(=O)N)NC(=O)C(NC(=O)C1CCCN1C(=O)C(C(C)C)N)CC(=O)N)C' "RIBAVIRIN": 'OCC1OC(C(C1O)O)n1cnc(n1)C(=O)N' "RR6": 'OCC(C(C(=O)NCCC(=O)Cc1ccccc1)O)(C)C' "RSV": 'Nc1ccc2c(n1)ccc(c2)c1cscc1' "RTV": 'O=C(NC(C(CC(Cc1ccccc1)NC(=O)C(C(C)C)NC(=O)N(Cc1csc(n1)C(C)C)C)O)Cc1ccccc1)OCc1cncs1' "RUT": 'Oc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O)c1ccc(c(c1)O)O' "RVT": 'Nc1nc(=O)n(cc1F)C1OC(C=C1)CO' "Raloxifene": 'Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O' "Ranexa": 'COc1ccccc1OCC(CN1CCN(CC1)CC(=O)Nc1c(C)cccc1C)O' "Ranolazine": 'COc1ccccc1OCC(CN1CCN(CC1)CC(=O)Nc1c(C)cccc1C)O' "Rapamycin": 'COC1CC(CCC1O)CC(C1OC(=O)C2CCCCN2C(=O)C(=O)C2(O)OC(CCC2C)CC(OC)C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)C1)C)C)O)OC)C)C)C)C' "RbCl": '[Cl-].[Rb+]' "RbOH": '[Rb+].[OH-]' "Re": '[Re]' "Red-Al": 'COCCO[Al+]OCCOC.[H-].[H-].[Na+]' "Regadenoson": 'OCC1OC(C(C1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC' "Repaglinide": 'CCOc1cc(ccc1C(=O)O)CC(=O)NC(c1ccccc1N1CCCCC1)CC(C)C' "Res": 'ONC(=O)C(C(COP(=O)(O)O)O)O' "Resorcinol": 'Oc1cccc(c1)O' "Resveratrol": 'Oc1ccc(cc1)C=Cc1cc(O)cc(c1)O' "Retinal": 'O=CC=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C' "Retinaldehyde": 'O=CC=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C' "Rh": '[Rh]' "Rh(OH)3": '[Rh+3].[OH-].[OH-].[OH-]' "Rh2(OAc)4": 'CC(=O)O[Rh]([Rh](OC(=O)C)OC(=O)C)OC(=O)C' "Rh2O3": '[O-2].[O-2].[O-2].[Rh+3].[Rh+3]' "Rh6G": 'CCOC(=O)c1ccccc1c1c2-c(oc3c1cc(C)c(c3)NCC)cc(=NCC)c(c2)C.Cl' "Rha": 'OC1C(C)OC(C(C1O)O)O' "Rhein": 'Oc1cc(cc2c1C(=O)c1c(C2=O)cccc1O)C(=O)O' "Rhenium": '[Re]' "Rhodium": '[Rh]' "Rhodium(II) Acetate": '[O-]C(=O)C.[O-]C(=O)C.[Rh+2]' "Rhodium(II) Octanoate": 'CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Rh+2]' "Rib": 'OC1COC(C(C1O)O)O' "Ribavirin": 'OCC1OC(C(C1O)O)n1cnc(n1)C(=O)N' "Ribose": 'OC1COC(C(C1O)O)O' "Rilpivirine": 'N#CC=Cc1cc(C)c(c(c1)C)Nc1ccnc(n1)Nc1ccc(cc1)C#N' "Rimonabant": 'Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CCCCC1' "Risperidone": 'Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2' "Ritonavir": 'O=C(NC(C(CC(Cc1ccccc1)NC(=O)C(C(C)C)NC(=O)N(Cc1csc(n1)C(C)C)C)O)Cc1ccccc1)OCc1cncs1' "Rivaroxaban": 'O=C1OC(CN1c1ccc(cc1)N1CCOCC1=O)CNC(=O)c1ccc(s1)Cl' "Rocuronium": 'C=CC[N+]1(CCCC1)C1CC2C(C1OC(=O)C)(C)CCC1C2CCC2C1(C)CC(C(C2)O)N1CCOCC1' "Roflumilast": 'FC(Oc1ccc(cc1OCC1CC1)C(=O)Nc1c(Cl)cncc1Cl)F' "Rolapitant": 'O=C1CCC2(N1)CCC(NC2)(COC(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1' "Romidepsin": 'CC=C1NC(=O)C2CSSCCC=CC(OC(=O)C(NC1=O)C(C)C)CC(=O)NC(C(=O)N2)C(C)C' "Ropion": 'CC(=O)OC(OC(=O)C(c1ccc(c(c1)F)c1ccccc1)C)C' "Rosi": 'O=C1NC(=O)C(S1)Cc1ccc(cc1)OCCN(c1ccccn1)C' "Rosiglitazone": 'O=C1NC(=O)C(S1)Cc1ccc(cc1)OCCN(c1ccccn1)C' "Rotenone": 'COc1cc2c(cc1OC)OCC1C2C(=O)c2c(O1)c1CC(Oc1cc2)C(=C)C' "Rotigotine": 'CCCN(C1CCc2c(C1)cccc2O)CCc1cccs1' "Rottlerin": 'O=C(c1c(O)c(Cc2c(O)c(C)c(c(c2O)C(=O)C)O)c(c2c1OC(C)(C)C=C2)O)C=Cc1ccccc1' "Ru": '[Ru]' "RuCl3": '[Cl-].[Cl-].[Cl-].[Ru+3]' "RuO2": 'O=[Ru]=O' "Ruthenium": '[Ru]' "Ruthenium(III) Chloride": '[Cl-].[Cl-].[Cl-].[Ru+3]' "Rutin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O)c1ccc(c(c1)O)O' "Ruxolitinib": 'N#CCC(n1ncc(c1)c1ncnc2c1cc[nH]2)C1CCCC1' "S-Ethyl Trifluorothioacetate": 'CCSC(=O)C(F)(F)F' "S-S": 'OCC(C(=O)NC(C(=O)O)CO)N' "S-adenosylhomocysteine": 'OC(=O)C(CCSCC1OC(C(C1O)O)n1cnc2c1ncnc2N)N' "S-tetralol": 'OC1CCCc2c1cccc2' "S1P": 'CCCCCCCCCCCCCC=CC(C(COP(=O)(O)O)N)O' "S1RA": 'Cc1cc(nn1c1ccc2c(c1)cccc2)OCCN1CCOCC1' "SA9": 'OCc1ccccc1O' "SAB": 'CC(=O)O[BH-](OC(=O)C)OC(=O)C.[Na+]' "SAH": 'OC(=O)C(CCSCC1OC(C(C1O)O)n1cnc2c1ncnc2N)N' "SAHA": 'ONC(=O)CCCCCCC(=O)Nc1ccccc1' "SAM": 'C[S+](CC1OC(C(C1O)O)n1cnc2c1ncnc2N)CCC(C(=O)[O-])N' "SAMP": 'COC[C@@H]1CCCN1N' "SAR": 'CNCC(=O)O' "SCFA": '[O-]C(=O)C.[Na+]' "SDBS": 'CCCCCCCCCCCCc1ccccc1S(=O)(=O)[O-].[Na+]' "SDG": 'OCC1OC(OCC(C(Cc2ccc(c(c2)OC)O)COC2OC(CO)C(C(C2O)O)O)Cc2ccc(c(c2)OC)O)C(C(C1O)O)O' "SDM": 'CN(CCCN1C(=O)C=CC1=O)C.C=Cc1ccccc1' "SDMA": 'CNC(=NC)NCCCC(C(=O)O)N' "SDS": 'CCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]' "SFA": 'CCC1CC(C)C2(NC1=O)OC(CC(C(CCC=CC=C(C1CC=CC=CC(O)C(C)C(O)C(CCC(=O)C)C(=O)NC(C(=O)NC(C(=O)N3NC(C(=O)O1)CCC3)Cc1cccc(c1)O)C(C)C)C)C)O)C(C(C2C)O)C' "SFN": 'S=C=NCCCCS(=O)C' "SFO": 'OS(=O)O' "SIS": 'NCC1=CCC(C(O1)OC1C(N)CC(C(C1O)OC1OCC(C(C1O)NC)(C)O)N)N' "SLB": 'OCC(C(C1OC(O)(CC(C1NC(=O)C)O)C(=O)O)O)O' "SMB": 'O=C1O[BH2-]C(=O)C1.[Na+]' "SMCC": 'O=C(C1CCC(CC1)CN1C(=O)C=CC1=O)ON1C(=O)CCC1=O' "SMP": 'COC[C@@H]1CCCN1' "SMe2": 'CSC' "SMe3I": 'C[S+](C)C.[I-]' "SNO": '[O-][N+](=O)c1ccc(cc1)C1OC1' "SO2": 'O=S=O' "SO2Cl2": 'ClS(=O)(=O)Cl' "SO3": 'O=S(=O)=O' "SO3 C5H5N": 'c1cccnc1.O=S(=O)=O' "SOCl2": 'ClS(=O)Cl' "SOP": 'O=C(NCCSCC(=O)C)CCNC(=O)C(C(COP(=O)(OP(=O)(OCC1OC(C(C1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O' "SOX": 'O=C(Cc1ccccc1)NC1C(=O)N2C1S(=O)C(C2C(=O)O)(C)C' "SPB": '[O-][B](=O)=O.[Na+]' "SPC": '[O-]OC(=O)[O-].[Na+].[Na+]' "SPDA": 'O=C1OC(=O)c2c1cc(cc2)Sc1ccc2c(c1)C(=O)OC2=O' "STO": 'CNC1CC2OC(C1OC)(C)n1c3ccccc3c3c1c1n2c2ccccc2c1c1c3CNC1=O' "STX": 'CNCC(=O)c1nnc(o1)C(C)(C)C' "Safranal": 'O=CC1=C(C)C=CCC1(C)C' "Salcomine [=N,N'-Bis(salicylidene)ethylenediiminocobalt(II)]": '[O-]c1ccccc1/C=N/CC/N=C/c1ccccc1[O-].[Co+2]' "Salidroside": 'OCC1OC(OCCc2ccc(cc2)O)C(C(C1O)O)O' "Salsolinol": 'CC1NCCc2c1cc(O)c(c2)O' "Samarium": '[Sm]' "Samarium(II) Iodide": '[I-].[I-].[Sm+2]' "Saquinavir": 'NC(=O)CC(C(=O)NC(C(CN1CC2CCCCC2CC1C(=O)NC(C)(C)C)O)Cc1ccccc1)NC(=O)c1ccc2c(n1)cccc2' "Sar": 'CNCC(=O)O' "Sarin": 'CC(OP(=O)(F)C)C' "Sarothrin": 'COc1c(O)c(OC)c2c(c1O)c(=O)c(c(o2)c1ccc(cc1)O)OC' "Sb2Te3": '[Sb]=[Te].[Sb]=[Te].[Te]' "Sc": '[Sc]' "Scandium": '[Sc]' "Scandium(III) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Sc+3]' "Sciadopitysin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)c(c(cc2O)O)c1cc(ccc1OC)c1cc(=O)c2c(o1)cc(cc2O)OC' "Scoparone": 'COc1cc2oc(=O)ccc2cc1OC' "Scopoletin": 'COc1cc2ccc(=O)oc2cc1O' "Scopolin": 'OCC1OC(Oc2cc3oc(=O)ccc3cc2OC)C(C(C1O)O)O' "Scutellarin": 'OC(=O)C1OC(Oc2cc3oc(cc(=O)c3c(c2O)O)c2ccc(cc2)O)C(C(C1O)O)O' "SeMet": 'C[Se]CCC(C(=O)O)N' "SeO2": 'O=[Se]=O' "Sec": 'N[C@H](C(=O)O)C[SeH]' "Secoisolariciresinol": 'OCC(C(Cc1ccc(c(c1)OC)O)CO)Cc1ccc(c(c1)OC)O' "Selectfluor": 'F[B-](F)(F)F.F[B-](F)(F)F.ClC[N+]12CC[N+](CC1)(CC2)F' "Selenite": '[O-][Se](=O)[O-]' "Ser": 'OC[C@@H](C(=O)O)N' "Ser-His": 'OCC(C(=O)NC(C(=O)O)Cc1[nH]cnc1)N' "Serine": 'OCC(C(=O)O)N' "Serotonin": 'NCCc1c[nH]c2c1cc(O)cc2' "Serratin": 'Oc1cc(O)c2c(c1)oc(=O)cc2c1ccccc1' "SiMe3Br": 'C[Si](Br)(C)C' "SiMeCl": 'C[Si](Cl)(C)C' "SiO2": 'O=[Si]=O' "Sia2BH": 'OC[C@H]([C@H]([C@@H]1O[C@](O)(CBC[C@]2(O)C[C@H](O)[C@H]([C@@H](O2)[C@@H]([C@@H](CO)O)O)NC(=O)C)C[C@@H]([C@H]1NC(=O)C)O)O)O' "Sibutramine": 'CC(CC(C1(CCC1)c1ccc(cc1)Cl)N(C)C)C' "Sildenafil": 'CCCc1nn(c2c1[nH]c(nc2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCN(CC1)C)C' "Silibinin": 'OCC1Oc2ccc(cc2OC1c1ccc(c(c1)OC)O)C1Oc2cc(O)cc(c2C(=O)C1O)O' "Silica": 'O=[Si]=O' "Silver": '[Ag]' "Silver Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.[Ag+]' "Silver(I) Trifluoromethanethiolate": '[S-]C(F)(F)F.[Ag+]' "Silver(II) Pyridine-2-carboxylate": '[O-]C(=O)c1ccccn1.[O-]C(=O)c1ccccn1.[Ag+2]' "Simvastatin": 'CCC(C(=O)OC1CC(C)C=C2C1C(CCC1CC(O)CC(=O)O1)C(C=C2)C)(C)C' "Sinensetin": 'COc1ccc(cc1OC)c1cc(=O)c2c(o1)cc(c(c2OC)OC)OC' "Sitagliptin": 'NC(Cc1cc(F)c(cc1F)F)CC(=O)N1CCn2c(C1)nnc2C(F)(F)F' "Sitosterol": 'CCC(C(C)C)CCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O)C' "Sm": '[Sm]' "SmI2": '[I-].[I-].[Sm+2]' "Sn(OH)4": '[Sn+4].[OH-].[OH-].[OH-].[OH-]' "SnCl4": '[Cl-].[Cl-].[Cl-].[Cl-].[Sn+4]' "SnHBu3": 'CCCC[Sn](CCCC)CCCC' "SnMe3Cl": 'C[Sn](Cl)(C)C' "SnO2": 'O=[Sn]=O' "Sodium (Trihydroxy)phenylborate": 'O[B-](c1ccccc1)(O)O.[Na+]' "Sodium Bis(2-methoxyethoxy)aluminum Dihydride": 'COCCO[Al+]OCCOC.[H-].[H-].[Na+]' "Sodium Bis(trimethylsilyl)amide": 'C[Si]([N-][Si](C)(C)C)(C)C.[Na+]' "Sodium Borohydride": '[Na+].[BH4-]' "Sodium Bromodifluoroacetate": '[O-]C(=O)C(Br)(F)F.[Na+]' "Sodium Chlorodifluoroacetate": '[O-]C(=O)C(Cl)(F)F.[Na+]' "Sodium Cyanoborohydride [Reducing Agent]": '[BH3-]C#N.[Na+]' "Sodium Dichloroisocyanurate": 'O=c1n(Cl)c(=O)[n-]c(=O)n1Cl.[Na+]' "Sodium Diphenylphosphinobenzene-3-sulfonate": '[O-]S(=O)(=O)c1cccc(c1)P(c1ccccc1)c1ccccc1.[Na+]' "Sodium Ethoxide": '[O-]CC.[Na+]' "Sodium Hydride": '[H-].[Na+]' "Sodium Hypochlorite Pentahydrate": '[O-]Cl.[Na+].O.O.O.O.O' "Sodium Methoxide": '[O-]C.[Na+]' "Sodium Tellurite Pentahydrate": '[O-][Te](=O)[O-].[Na+].[Na+].O.O.O.O.O' "Sodium Tetrachloropalladate(II)": 'Cl[Pd-2](Cl)(Cl)Cl.[Na+].[Na+]' "Sodium Tetrafluoroborate": 'F[B-](F)(F)F.[Na+]' "Sodium Triacetoxyborohydride": 'CC(=O)O[BH-](OC(=O)C)OC(=O)C.[Na+]' "Sodium Trifluoroacetate": '[O-]C(=O)C(F)(F)F.[Na+]' "Sodium Trifluoromethanesulfinate": 'FC(S(=O)[O-])(F)F.[Na+]' "Sodium Tris(1,1,1,3,3,3-hexafluoroisopropoxy)borohydride": 'FC(C(C(F)(F)F)O[BH-](OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)(F)F.[Na+]' "Sodiumtert-Butoxide": '[O-]C(C)(C)C.[Na+]' "Sodiumtert-Pentoxide": 'CCC(C)(C)[O-].[Na+]' "Soman": 'CC(C(C)(C)C)OP(=O)(F)C' "Sophocarpine": 'O=C1C=CCC2N1CC1CCCN3C1C2CCC3' "Sorafenib": 'CNC(=O)c1nccc(c1)Oc1ccc(cc1)NC(=O)Nc1ccc(c(c1)C(F)(F)F)Cl' "Sorbic Acid": 'C/C=C/C=C/C(=O)O' "Span-80": 'CCCCCCCCC=CCCCCCCCC(=O)OCC(C1OCC(C1O)O)O' "Spironolactone": 'CC(=O)SC1CC2=CC(=O)CCC2(C2C1C1CCC3(C1(CC2)C)CCC(=O)O3)C' "Spongiatriol": 'OCC12CCC3C(C2CCc2c1coc2)(C)CC(=O)C(C3(C)CO)O' "Squalamine": 'NCCCCNCCCNC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(C(C)C)OS(=O)(=O)O)C)C)O)C' "Squalene": 'CC(=CCCC=C(CCC=C(CCC=C(C)C)C)C)CCC=C(CCC=C(C)C)C' "Sr(OH)2": '[Sr+2].[OH-].[OH-]' "SrO2": '[O-][O-].[Sr+2]' "Stearoyl-CoA": 'CCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(COP(=O)(OP(=O)(OCC1OC(C(C1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O' "Stilbene": 'c1ccc(cc1)C=Cc1ccccc1' "Stiripentol": 'OC(C(C)(C)C)C=Cc1ccc2c(c1)OCO2' "Streptomycin": 'OCC1OC(OC2C(OC3C(O)C(O)C(C(C3N=C(N)N)O)N=C(N)N)OC(C2(O)C=O)C)C(C(C1O)O)NC' "Styrene": 'C=Cc1ccccc1' "SuA": 'CCCOC(=S)Nc1ccc(cc1)S(=O)(=O)N' "SubPc": 'Clb1n2c3nc4n1c(nc1-c5c(-c(nc2c2c3cccc2)n1)cccc5)c1c4cccc1' "Succinic Acid": 'OC(=O)CCC(=O)O' "Sucrose": 'OCC1OC(C(C1O)O)(CO)OC1OC(CO)C(C(C1O)O)O' "Sulfanilic Acid": 'Nc1ccc(cc1)S(=O)(=O)O' "Sulforaphane": 'S=C=NCCCCS(=O)C' "Sulforaphene": 'CS(=O)C=CCCN=C=S' "Sulfur Trioxide - Triethylamine Complex": 'O=S(=O)=O.CCN(CC)CC' "Sulphanilamide": 'Nc1ccc(cc1)S(=O)(=O)N' "Sulpiride": 'CCN1CCCC1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N' "Sumatriptan": 'CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2' "Sunitinib": 'CCN(CCNC(=O)c1c(C)[nH]c(c1C)C=C1C(=O)Nc2c1cc(F)cc2)CC' "Superoxide": '[O-][O]' "Suramin": 'O=C(Nc1cccc(c1)C(=O)Nc1cc(ccc1C)C(=O)Nc1ccc(c2c1c(cc(c2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)Nc1cccc(c1)C(=O)Nc1cc(ccc1C)C(=O)Nc1ccc(c2c1c(cc(c2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O' "Sweroside": 'C=CC1C(OC=C2C1CCOC2=O)OC1OC(CO)C(C(C1O)O)O' "Swertiamarin": 'C=CC1C(OC=C2C1(O)CCOC2=O)OC1OC(CO)C(C(C1O)O)O' "Syprine": 'NCCNCCNCCN.Cl.Cl' "T-2": 'Clc1ccc(c(c1Cl)C(=O)O)Cl' "TADDOL": 'CC1CCC2C(C1)(C2(C)C)C(C12CC(C)CCC1C2(C)C)(C1OCOC1C(C12CC(C)CCC1C2(C)C)(C12CC(C)CCC1C2(C)C)O)O' "TAG": 'OCC1(O)OCC(C(C1O)O)O' "TAME": 'CCC(OC)(C)C' "TASF": 'C[Si-](F)(F)(C)C.CN([S+](N(C)C)N(C)C)C' "TBAB": 'CCCC[N+](CCCC)(CCCC)CCCC.[Br-]' "TBAC": 'CCCC[N+](CCCC)(CCCC)CCCC.[BH3-]C#N' "TBACC": '[O-][Cr](=O)(=O)Cl.CCCC[N+](CCCC)(CCCC)CCCC' "TBAF": 'CCCC[N+](CCCC)(CCCC)CCCC.[F-]' "TBAHS": '[O-]S(=O)(=O)O.CCCC[N+](CCCC)(CCCC)CCCC' "TBAI": 'CCCC[N+](CCCC)(CCCC)CCCC.[I-]' "TBAP": '[O-][Cl](=O)(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC' "TBAT": 'F[Si-](c1ccccc1)(c1ccccc1)(c1ccccc1)F.CCCC[N+](CCCC)(CCCC)CCCC' "TBATB": 'CCCC[N+](CCCC)(CCCC)CCCC.[Br-].[Br-].[Br-]' "TBBPA": 'CC(c1cc(Br)c(c(c1)Br)O)(c1cc(Br)c(c(c1)Br)O)C' "TBCK": 'O=C=C(C(C)(C)C)C#N' "TBCO": 'BrC1=CC(Br)(Br)C=C(C1=O)Br' "TBE": 'BrCC(Br)(Br)Br' "TBF": 'OC=O' "TBHN": '[O-]N(C(C)(C)C)C(C)(C)C' "TBHP": 'OOC(C)(C)C' "TBHQ": 'Oc1ccc(c(c1)C(C)(C)C)O' "TBME": 'COC(C)(C)C' "TBOA": 'NC(C(C(=O)O)OCc1ccccc1)C(=O)O' "TBP": 'CCCCOP(=O)(OCCCC)OCCCC' "TBPB": 'Cc1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c(=O)[nH]c2c1cccc2' "TBST": 'CC(O[Si](OC(C)(C)C)(OC(C)(C)C)S)(C)C' "TBT": 'Cc1ccc(cc1)C(C)(C)C' "TBTH": 'CCCC[SnH](CCCC)CCCC' "TBTO": 'CCCC[Sn](O[Sn](CCCC)(CCCC)CCCC)(CCCC)CCCC' "TBTU": 'F[B-](F)(F)F.CN(C(=[O+]n1nnc2c1cccc2)N(C)C)C' "TC": '[O-]C(=O)c1cccs1' "TCA": 'OC(=O)C(Cl)(Cl)Cl' "TCAA": 'O=C(C(Cl)(Cl)Cl)OC(=O)C(Cl)(Cl)Cl' "TCB": 'Clc1[nH]c2c(n1)cc(c(c2)Cl)Cl' "TCDD": 'Clc1cc2Oc3cc(Cl)c(cc3Oc2cc1Cl)Cl' "TCDI": 'S=C(n1cncc1)n1cncc1' "TCE": 'ClC=C(Cl)Cl' "TCF": 'ClC(=O)OC(Cl)(Cl)Cl' "TCM": 'ClC(Cl)Cl' "TCNE": 'N#CC(=C(C#N)C#N)C#N' "TCNQ": 'N#CC(=c1ccc(=C(C#N)C#N)cc1)C#N' "TCPOBOP": 'Clc1cnc(c(c1)Cl)Oc1ccc(cc1)Oc1ncc(cc1Cl)Cl' "TCS": 'ClC1(Cl)CS(=O)(=O)CC1(Cl)Cl' "TCTA": 'c1ccc2c(c1)n(c1ccc(cc1)N(c1ccc(cc1)n1c3ccccc3c3c1cccc3)c1ccc(cc1)n1c3ccccc3c3c1cccc3)c1c2cccc1' "TDAE": 'CN(C(=C(N(C)C)N(C)C)N(C)C)C' "TDCM": 'CCCCCCCCCCCCCCC(C(=O)OCC1OC(OC2OC(COC(=O)C(C(CCCCCCCCCCCCCCC)O)CCCCCCCCCCCCCC)C(C(C2O)O)O)C(C(C1O)O)O)C(CCCCCCCCCCCCCCC)O' "TDCPP": 'ClCC(OP(=O)(OC(CCl)CCl)OC(CCl)CCl)CCl' "TDI": 'O=C=Nc1ccc(c(c1)N=C=O)C' "TDMAC": 'CCCCCCCCCCCCC[NH2+]C.[Cl-]' "TDMPP": 'COc1cccc(c1P(c1c(OC)cccc1OC)c1c(OC)cccc1OC)OC' "TEA": 'CCN(CC)CC' "TEAA": '[O-]C(=O)C.CC[N+](CC)(CC)CC' "TEAB": 'CC[N+](CC)(CC)CC.[Br-]' "TEABH": 'CC[N+](CC)(CC)CC.[BH4-]' "TEAC": 'CC[N+](CC)(CC)CC.[Cl-]' "TEAHC": '[O-]C(=O)O.CC[N+](CC)(CC)CC' "TEAOH": 'CC[N+](CC)(CC)CC.[OH-]' "TEAP": '[O-][Cl](=O)(=O)=O.CC[N+](CC)(CC)CC' "TEBA": 'CC[N+](Cc1ccccc1)(CC)CC.[Cl-]' "TEBAC": 'CC[N+](Cc1ccccc1)(CC)CC.[Cl-]' "TEBACl": 'CC[N+](Cc1ccccc1)(CC)CC.[Cl-]' "TEC": 'CCOC(=O)C(CC(=O)OCC)(CC(=O)OCC)O' "TEF": 'O=P(N1CC1)(N1CC1)N1CC1' "TEMPO": '[O]N1C(C)(C)CCCC1(C)C' "TEOS": 'CCO[Si](OCC)(OCC)OCC' "TEP": 'CCOP(OCC)OCC' "TEPA": 'O=P(N1CC1)(N1CC1)N1CC1' "TES": 'OCC(NCCS(=O)(=O)O)(CO)CO' "TESOTf": 'CC[Si](OC(=O)C(F)(F)F)(CC)CC' "TETA": 'NCCNCCNCCN' "TEtA": 'NCCNCCNCCN' "TFA": 'OC(=O)C(F)(F)F' "TFAA": 'O=C(C(F)(F)F)OC(=O)C(F)(F)F' "TFE": 'OCC(F)(F)F' "TFFH": 'F[P-](F)(F)(F)(F)F.CN(C(=[N+](C)C)F)C' "TFP": 'c1coc(c1)P(c1ccco1)c1ccco1' "TFPB": 'FC(c1cc(cc(c1)C(F)(F)F)[B-](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(F)F' "TFTTF": 'O=CC1=C(C=O)SC(=C2SC(=C(S2)C=O)C=O)S1' "THAB": 'CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[Br-]' "THAM": 'OCC(CO)(CO)N' "THBC": 'N1CCc2c(C1)[nH]c1c2cccc1' "THC": 'CCCCCc1cc(O)c2c(c1)OC(C1C2C=C(C)CC1)(C)C' "THF.BH3": 'C1CCCO1.B' "THFBH3": 'C1CCCO1.B' "THIIC": 'Cn1cnc(c1)C(=O)NCc1ccc(cc1)COc1ccc(c(c1C(F)(F)F)O)C(=O)C(C)C' "THIP": 'O=c1[nH]oc2c1CCNC2' "THP": 'C1CCCOC1' "THT": 'C1CCCS1' "THY": 'Cc1c[nH]c(=O)[nH]c1=O' "TIBO": 'CC(=CCN1Cc2cccc3c2n(CC1C)c(=S)[nH]3)C' "TIP": '[O-]C(C)C.[O-]C(C)C.[O-]C(C)C.[O-]C(C)C.[Ti+4]' "TLM": 'C=CC(=CC1(C)SC(=C(C1=O)C)O)C' "TMAB": 'C[N+](C)(C)C.[Br-]' "TMAC": 'C[N+](C)(C)C.[Cl-]' "TMACC": '[O-][Cr](=O)(=O)Cl.C[N+](C)(C)C' "TMAF": 'C[N+](C)(C)C.[F-]' "TMAH": 'C[N+](C)(C)C.[OH-]' "TMAM": 'C[N+](c1ccccc1)(C)C.[O-]C' "TMANO": '[O-][N+](C)(C)C' "TMAO": '[O-][N+](C)(C)C' "TMB": 'Cc1c(C)cccc1C' "TMB4": 'O=[NH+]C=C1C=CN(C=C1)CCCN1C=CC(=C[NH+]=O)C=C1.[Br-].[Br-]' "TMCHD": 'CN(C1CCCCC1N(C)C)C' "TMClS": 'C[Si](Cl)(C)C' "TMEDA": 'CC(C(N)(C)C)(N)C' "TMG": 'CN(C(=N)N(C)C)C' "TMN": 'N#Cc1cc(C#N)cc(c1)C#N' "TMNO": '[O-][N+](C)(C)C' "TMO": '[O-][N+](C)(C)C' "TMOF": 'COC(OC)OC' "TMOS": 'CO[Si](OC)(OC)OC' "TMP": 'CC1(C)CCCC(N1)(C)C' "TMPD": 'CN(CCCN(C)C)C' "TMPDA": 'CN(CCCN(C)C)C' "TMPH": 'CC1(C)CCCC(N1)(C)C' "TMPO": 'CP(=O)(C)C' "TMPP": 'CCC(COP(O)O)(CO)CO' "TMRM": '[O-][Cl](=O)(=O)=O.COC(=O)c1ccccc1c1c2-c(oc3c1ccc(c3)N(C)C)cc(=[N+](C)C)cc2' "TMS": 'C[Si](C)(C)C' "TMSA": 'C[Si](C)(N=​[N+]=[N-])C' "TMSN3": 'C[Si](C)(N=​[N+]=[N-])C' "TMS-azide": 'C[Si](C)(N=​[N+]=[N-])C' "TMS-Imidazole (=N-Trimethylsilylimidazole)": 'C[Si](n1cncc1)(C)C' "TMSBr": 'C[Si](Br)(C)C' "TMSD": 'C[Si](C=[N+]=[N-])(C)C' "TMSI": 'C[Si](I)(C)C' "TMSMA": 'C[Si](CN=[N+]=[N-])(C)C' "TMSOF": 'C[Si](Oc1ccco1)(C)C' "TMTBG": 'C/N=C(/N(C(C)(C)C)C)\N(C)C' "TMTD": 'CN(C(=S)SSC(=S)N(C)C)C' "TMTHF": 'CC1(C)CCC(O1)(C)C' "TMTr": 'COc1ccc(cc1)[C](c1ccc(cc1)OC)c1ccc(cc1)OC' "TMU": 'CN(C(=O)N(C)C)C' "TNBS": '[O-][N+](=O)c1cc(cc(c1S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]' "TNCB": '[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][Br](=O)=O.[Ce+4]' "TNN": '[O-][N+](=O)c1cc2cc(cc(c2c(c1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]' "TNOHX": 'O=NN1CN(N=O)CN(C1)N=O' "TNT": '[O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C' "TOA": 'CCCCCCCCN(CCCCCCCC)CCCCCCCC' "TOCP": 'Cc1ccccc1OP(=O)(Oc1ccccc1C)Oc1ccccc1C' "TOL": 'Cc1ccccc1' "TOMAC": 'CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C.[Cl-]' "TOSMIC": 'Cc1ccc(cc1)S(=O)(=O)C[N+]#[C-]' "TPA": 'c1ccc(nc1)CN(Cc1ccccn1)Cc1ccccn1' "TPAP": '[O-][Ru](=O)(=O)=O.CCC[N+](CCC)(CCC)CCC' "TPCD": 'c1cccnc1.c1cccnc1.c1cccnc1.c1cccnc1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Co+2]' "TPDS": 'c1ccc(cc1)[SiH]([SiH](c1ccccc1)c1ccccc1)c1ccccc1' "TPGS": 'OCCOC(=O)CCC(=O)Oc1c(C)c(C)c2c(c1C)CCC(O2)(C)CCCC(CCCC(CCCC(C)C)C)C' "TPP": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1' "TPPDS": '[O-]S(=O)(=O)c1ccc(cc1)P(c1ccc(cc1)S(=O)(=O)[O-])c1ccccc1' "TPPO": 'O=P(c1ccccc1)(c1ccccc1)c1ccccc1' "TPPS": 'OS(=O)(=O)c1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(c3[nH]c(C(=C4N=C1C=C4)c1ccc(cc1)S(=O)(=O)O)cc3)c1ccc(cc1)S(=O)(=O)O)[nH]2)c1ccc(cc1)S(=O)(=O)O' "TPPTS": '[O-]S(=O)(=O)c1cccc(c1)P(c1cccc(c1)S(=O)(=O)[O-])c1cccc(c1)S(=O)(=O)[O-].[Na+].[Na+].[Na+]' "TPPU": 'CCC(=O)N1CCC(CC1)NC(=O)Nc1ccc(cc1)OC(F)(F)F' "TPS": 'O[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "TPST": 'S[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "TPT": 'c1ccc(cc1)c1cc([o+]c(c1)c1ccccc1)c1ccccc1.F[B-](F)(F)F' "TPTH": 'c1ccc(cc1)[SnH](c1ccccc1)c1ccccc1' "TPTN": 'C(CN(Cc1ccccn1)Cc1ccccn1)CN(Cc1ccccn1)Cc1ccccn1' "TPTZ": 'c1ccc(nc1)c1nc(nc(n1)c1ccccn1)c1ccccn1' "TR-DHPE": 'CCN(CC)CC.CCCCCCCCCCCCCCCC(=O)OC(COP(=O)(OCCNS(=O)(=O)c1ccc(c(c1)S(=O)(=O)[O-])C1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3c1c2CCC3)CCC4)O)COC(=O)CCCCCCCCCCCCCCC' "TRAM-34": 'Clc1ccccc1C(n1cccn1)(c1ccccc1)c1ccccc1' "TREAT-HF": 'CCN(CC)CC.F.F.F' "TREN": 'NCCN(CCN)CCN' "TRIM": 'FC(c1ccccc1n1cncc1)(F)F' "TRIS": 'OCC(CO)(CO)N' "TRP": 'OC(=O)C(Cc1c[nH]c2c1cccc2)N' "TRY": 'OC(=O)C(Cc1c[nH]c2c1cccc2)N' "TSA": 'ONC(=O)C=CC(=CC(C(=O)c1ccc(cc1)N(C)C)C)C' "TSN": 'ONC(=O)C=CC(=CC(C(=O)c1ccc(cc1)N(C)C)C)C' "TTA": '[O-]C(=O)C.[O-]C(=O)C.[O-]C(=O)C.[Tl+3]' "TTBP": 'CC(c1cc(nc(n1)C(C)(C)C)C(C)(C)C)(C)C' "TTC": 'c1ccc(cc1)c1nn([n+](n1)c1ccccc1)c1ccccc1.[Cl-]' "TTF": 'C1=CSC(=C2SC=CS2)S1' "TTFA": '[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[Tl+3]' "TTFB": 'c1ccc(cc1)[C+](c1ccccc1)c1ccccc1.F[B-](F)(F)F' "TTMPP": 'COc1cc(OC)cc(c1P(c1c(OC)cc(cc1OC)OC)c1c(OC)cc(cc1OC)OC)OC' "TTMSS": 'C[Si]([SiH]([Si](C)(C)C)[Si](C)(C)C)(C)C' "TTN": '[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[Tl+3]' "TTNB": '[O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])[N+](=O)[O-]' "TTT": 'c1ccc(cc1)CN1CN(CN(C1)Cc1ccccc1)Cc1ccccc1' "TUDCA": 'OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)NCCS(=O)(=O)O)C)C)O)C' "TZD": 'Cc1ncc(c(n1)N)Cn1c(=O)sc(c1C)CCOP(=O)(OP(=O)(O)O)O' "Tacrine": 'Nc1c2CCCCc2nc2c1cccc2' "Tadalafil": 'O=C1N(C)CC(=O)N2C1Cc1c(C2c2ccc3c(c2)OCO3)[nH]c2c1cccc2' "Tamoxifen": 'CCC(=C(c1ccccc1)c1ccc(cc1)OCCN(C)C)c1ccccc1' "Tandemact": 'CCC1=C(C)CN(C1=O)C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCC(CC1)C.CCc1ccc(nc1)CCOc1ccc(cc1)CC1SC(=O)NC1=O.Cl' "Tandutinib": 'COc1cc2c(cc1OCCCN1CCCCC1)ncnc2N1CCN(CC1)C(=O)Nc1ccc(cc1)OC(C)C' "Targretin": 'Cc1cc2c(cc1C(=C)c1ccc(cc1)C(=O)O)C(C)(C)CCC2(C)C' "Tartrazin": '[O-]C(=O)C1=NN(C(=O)C1=NNc1ccc(cc1)S(=O)(=O)[O-])c1ccc(cc1)S(=O)(=O)[O-].[Na+].[Na+].[Na+]' "Tau": 'NCCS(=O)(=O)O' "Taxol": 'CC(=O)OC1C(=O)C2(C)C(O)CC3C(C2C(C2(C(C1=C(C)C(OC(=O)C(C(c1ccccc1)NC(=O)c1ccccc1)O)C2)(C)C)O)OC(=O)c1ccccc1)(CO3)OC(=O)C' "Taxotere": 'CC(=O)OC12COC1CC(C1(C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(C(c3ccccc3)NC(=O)OC(C)(C)C)O)C(=C(C2(C)C)C(C1=O)O)C)C)O' "Tb": '[Tb]' "Tbos": 'CC(O[Si](Cl)(C)C)(C)C' "TeO2": '[O-2].[O-2].[Te+4]' "Tebbe reagent": '[cH-]1cccc1.[cH-]1cccc1.C[Al-]1(C)C[Ti+2][Cl+]1' "Tecadenoson": 'OCC1OC(C(C1O)O)n1cnc2c1ncnc2NC1COCC1' "Telluric Acid": 'O[Te](=O)(=O)O' "Tellurium(IV) Oxide": '[O-2].[O-2].[Te+4]' "Telmisartan": 'CCCc1nc2c(n1Cc1ccc(cc1)c1ccccc1C(=O)O)cc(cc2C)c1nc2c(n1C)cccc2' "Temozolomide": 'NC(=O)c1ncn2c1nnn(c2=O)C' "Terbinafine": 'CN(Cc1cccc2c1cccc2)CC=CC#CC(C)(C)C' "Terbium": '[Tb]' "Teriflunomide": 'N#CC(=C(O)C)C(=O)Nc1ccc(cc1)C(F)(F)F' "Testosterone": 'O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2O)C)C' "Tetra(decyl)ammonium Bromide": 'CCCCCCCCCC[N+](CCCCCCCCCC)(CCCCCCCCCC)CCCCCCCCCC.[Br-]' "Tetra-n-octylammonium Bromide": 'CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-]' "Tetra-n-octylammonium Iodide": 'CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[I-]' "Tetra-n-octylphosphonium Bromide": 'CCCCCCCC[P+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-]' "Tetraallyltin": 'C=CC[Sn](CC=C)(CC=C)CC=C' "Tetraamylammonium Bromide": 'CCCCC[N+](CCCCC)(CCCCC)CCCCC.[Br-]' "Tetraamylammonium Chloride": 'CCCCC[N+](CCCCC)(CCCCC)CCCCC.[Cl-]' "Tetraamylammonium Iodide": 'CCCCC[N+](CCCCC)(CCCCC)CCCCC.[I-]' "Tetrabromofluorescein": 'Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3c(Br)c(Br)c(c2Br)Br)ccc(c1)O' "Tetrabutyl Orthosilicate": 'CCCCO[Si](OCCCC)(OCCCC)OCCCC' "Tetrabutyl Orthotitanate": 'CCCCO[Ti](OCCCC)(OCCCC)OCCCC' "Tetrabutyl Orthotitanate Tetramer": '[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-]CCCC.[O-2].[O-2].[O-2].[Ti+4].[Ti+4].[Ti+4].[Ti+4]' "Tetrabutylammonium Acetate": '[O-]C(=O)C.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Bifluoride": 'CCCC[N+](CCCC)(CCCC)CCCC.[F-].F' "Tetrabutylammonium Borohydride": 'CCCC[N+](CCCC)(CCCC)CCCC.[BH4-]' "Tetrabutylammonium Bromide": 'CCCC[N+](CCCC)(CCCC)CCCC.[Br-]' "Tetrabutylammonium Chloride": 'CCCC[N+](CCCC)(CCCC)CCCC.[Cl-]' "Tetrabutylammonium Difluorotriphenylstannate": 'F[Sn-](c1ccccc1)(c1ccccc1)(c1ccccc1)F.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Dihydrogen Trifluoride": 'CCCC[N+](CCCC)(CCCC)CCCC.[H+].[H+].[F-].[F-].[F-]' "Tetrabutylammonium Fluoride": 'CCCC[N+](CCCC)(CCCC)CCCC.[F-]' "Tetrabutylammonium Fluoride Hydrate": 'CCCC[N+](CCCC)(CCCC)CCCC.[F-].O' "Tetrabutylammonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Hydrogen Sulfate": '[O-]S(=O)(=O)O.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Iodide": 'CCCC[N+](CCCC)(CCCC)CCCC.[I-]' "Tetrabutylammonium Perchlorate": '[O-][Cl](=O)(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Perrhenate": '[O-][Re](=O)(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Tetrafluoroborate": 'F[B-](F)(F)F.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Tetraphenylborate": 'c1ccc(cc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Thiocyanate": 'CCCC[N+](CCCC)(CCCC)CCCC.[S-]C#N' "Tetrabutylammonium Tribromide": 'CCCC[N+](CCCC)(CCCC)CCCC.[Br-].[Br-].[Br-]' "Tetrabutylammonium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CCCC[N+](CCCC)(CCCC)CCCC' "Tetrabutylammonium Triiodide": 'CCCC[N+](CCCC)(CCCC)CCCC.[I-].[I-].[I-]' "Tetrabutylgermane": 'CCCC[Ge](CCCC)(CCCC)CCCC' "Tetrabutylphosphonium Bromide": 'CCCC[P+](CCCC)(CCCC)CCCC.[Br-]' "Tetrabutylphosphonium Chloride": 'CCCC[P+](CCCC)(CCCC)CCCC.[Cl-]' "Tetrabutylphosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CCCC[P+](CCCC)(CCCC)CCCC' "Tetrabutylphosphonium Hydroxide": 'CCCC[P+](CCCC)(CCCC)CCCC.[OH-]' "Tetrabutylphosphonium Tetrafluoroborate": 'F[B-](F)(F)F.CCCC[P+](CCCC)(CCCC)CCCC' "Tetrabutyltin": 'CCCC[Sn](CCCC)(CCCC)CCCC' "Tetracaine": 'CCCCNc1ccc(cc1)C(=O)OCCN(C)C' "Tetracyanoethylene": 'N#CC(=C(C#N)C#N)C#N' "Tetradecamethylcycloheptasiloxane": 'C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C' "Tetradecyltrimethylammonium Bromide": 'CCCCCCCCCCCCCC[N+](C)(C)C.[Br-]' "Tetraethyl 1,4,8,11-Tetraazacyclotetradecane-1,4,8,11-tetraacetate": 'CCOC(=O)CN1CCCN(CCN(CCCN(CC1)CC(=O)OCC)CC(=O)OCC)CC(=O)OCC' "Tetraethyl Orthosilicate": 'CCO[Si](OCC)(OCC)OCC' "Tetraethylammonium Borohydride": 'CC[N+](CC)(CC)CC.[BH4-]' "Tetraethylammonium Bromide": 'CC[N+](CC)(CC)CC.[Br-]' "Tetraethylammonium Chloride": 'CC[N+](CC)(CC)CC.[Cl-]' "Tetraethylammonium Fluoride Tetrahydrofluoride": 'CC[N+](CC)(CC)CC.[F-].F.F.F.F' "Tetraethylammonium Fluoride Trihydrofluoride": 'CC[N+](CC)(CC)CC.[F-].F.F.F' "Tetraethylammonium Hydroxide": 'CC[N+](CC)(CC)CC.[OH-]' "Tetraethylammonium Iodide": 'CC[N+](CC)(CC)CC.[I-]' "Tetraethylammonium Nitrate": '[O-][N+](=O)[O-].CC[N+](CC)(CC)CC' "Tetraethylammonium Tetrafluoroborate": 'F[B-](F)(F)F.CC[N+](CC)(CC)CC' "Tetraethylammonium Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.CC[N+](CC)(CC)CC' "Tetraethylammoniump-Toluenesulfonate": 'Cc1ccc(cc1)S(=O)(=O)[O-].CC[N+](CC)(CC)CC' "Tetraethylgermane": 'CC[Ge](CC)(CC)CC' "Tetraethylphosphonium Bromide": 'CC[P+](CC)(CC)CC.[Br-]' "Tetraethylphosphonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CC[P+](CC)(CC)CC' "Tetraethylphosphonium Tetrafluoroborate": 'F[B-](F)(F)F.CC[P+](CC)(CC)CC' "Tetraethylsilane": 'CC[Si](CC)(CC)CC' "Tetraheptylammonium Bromide": 'CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[Br-]' "Tetraheptylammonium Iodide": 'CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[I-]' "Tetrahexylammonium Bromide": 'CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[Br-]' "Tetrahexylammonium Hydrogen Sulfate": '[O-]S(=O)(=O)O.CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC' "Tetrahexylammonium Hydroxide": 'CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[OH-]' "Tetrahexylammonium Iodide": 'CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[I-]' "Tetraisobutyl Orthotitanate": 'CC(CO[Ti](OCC(C)C)(OCC(C)C)OCC(C)C)C' "Tetraisopropyl Orthosilicate": 'CC(O[Si](OC(C)C)(OC(C)C)OC(C)C)C' "Tetraisopropyl Orthotitanate": 'CC(O[Ti](OC(C)C)(OC(C)C)OC(C)C)C' "Tetrakis(2,4-pentanedionato)titanium(IV) (ca. 63% in Isopropyl Alcohol)": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[O-]CCC.[O-]CCC.[Ti+4]' "Tetrakis(acetonitrile)copper(I) Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.CC#N.CC#N.CC#N.CC#N.[Cu+]' "Tetrakis(acetonitrile)copper(I) Tetrafluoroborate": 'F[B-](F)(F)F.CC#N.CC#N.CC#N.CC#N.[Cu+]' "Tetrakis(acetonitrile)palladium(II) Bis(trifluoromethanesulfonate)": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.CC#N.CC#N.CC#N.CC#N.[Pd+2]' "Tetrakis(dimethylamino)titanium(IV)": 'CN([Ti](N(C)C)(N(C)C)N(C)C)C' "Tetrakis(dimethylsilyl)silane": 'C[SiH]([Si]([SiH](C)C)([SiH](C)C)[SiH](C)C)C' "Tetrakis(dimethylsilyloxy)silane": 'C[SiH](O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C)C' "Tetrakis(hydroxymethyl)phosphonium Chloride": 'OC[P+](CO)(CO)CO.[Cl-]' "Tetrakis(hydroxymethyl)phosphonium Sulfate": '[O-]S(=O)(=O)[O-].OC[P+](CO)(CO)CO.OC[P+](CO)(CO)CO' "Tetrakis(trimethylsilyl)silane": 'C[Si]([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)(C)C' "Tetrakis(triphenylphosphine)palladium(0)": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Pd]' "Tetrakis[dimethyl(vinyl)silyl] Orthosilicate": 'C=C[Si](O[Si](O[Si](C=C)(C)C)(O[Si](C=C)(C)C)O[Si](C=C)(C)C)(C)C' "Tetramethylammonium Acetate": 'C[N+](C)(C)C.[O-]C(=O)C' "Tetramethylammonium Borohydride": 'C[N+](C)(C)C.[BH4-]' "Tetramethylammonium Bromide": 'C[N+](C)(C)C.[Br-]' "Tetramethylammonium Chloride": 'C[N+](C)(C)C.[Cl-]' "Tetramethylammonium Dichloroiodate": 'C[N+](C)(C)C.Cl[I-]Cl' "Tetramethylammonium Fluoride Tetrahydrate": 'C[N+](C)(C)C.[F-].O.O.O.O' "Tetramethylammonium Hexafluorophosphate": 'F[P-](F)(F)(F)(F)F.C[N+](C)(C)C' "Tetramethylammonium Hydroxide": 'C[N+](C)(C)C.[OH-]' "Tetramethylammonium Iodide": 'C[N+](C)(C)C.[I-]' "Tetramethylammonium Sulfate": '[O-]S(=O)(=O)[O-].C[N+](C)(C)C.C[N+](C)(C)C' "Tetramethylammonium Tetrafluoroborate": 'F[B-](F)(F)F.C[N+](C)(C)C' "Tetramethylammonium Triacetoxyborohydride": 'C[N+](C)(C)C.CC(=O)O[BH-](OC(=O)C)OC(=O)C' "Tetramethylgermane": 'C[Ge](C)(C)C' "Tetramethylsilane": 'C[Si](C)(C)C' "Tetraphenyl Lead": 'c1ccc(cc1)[Pb](c1ccccc1)(c1ccccc1)c1ccccc1' "Tetraphenylarsonium Chloride Hydrochloride Hydrate": 'c1ccc(cc1)[As+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-].Cl.O' "Tetraphenylcyclopentadienone": 'O=C1C(=C(C(=C1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1' "Tetraphenylgermane": 'c1ccc(cc1)[Ge](c1ccccc1)(c1ccccc1)c1ccccc1' "Tetraphenylphosphonium Bromide": 'c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]' "Tetraphenylphosphonium Chloride": 'c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]' "Tetraphenylporphyrin (Chlorin free)": 'c1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1ccccc1)C=C3)c1ccccc1)[nH]2)c1ccccc1' "Tetraphenylsilane": 'c1ccc(cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "Tetraphenyltin": 'c1ccc(cc1)[Sn](c1ccccc1)(c1ccccc1)c1ccccc1' "Tetrapropyl Orthosilicate": 'CCCO[Si](OCCC)(OCCC)OCCC' "Tetrapropylammonium Bromide": 'CCC[N+](CCC)(CCC)CCC.[Br-]' "Tetrapropylammonium Chloride": 'CCC[N+](CCC)(CCC)CCC.[Cl-]' "Tetrapropylammonium Hydroxide": 'CCC[N+](CCC)(CCC)CCC.[OH-]' "Tetrapropylammonium Iodide": 'CCC[N+](CCC)(CCC)CCC.[I-]' "Tetrapropylammonium Perruthenate": '[O-][Ru](=O)(=O)=O.CCC[N+](CCC)(CCC)CCC' "Tf2O": 'FC(S(=O)(=O)OS(=O)(=O)C(F)(F)F)(F)F' "TfOTf": 'FC(S(=O)(=O)OS(=O)(=O)C(F)(F)F)(F)F' "Tfe": '[CH2]C(F)(F)F' "Th": '[Th]' "ThDP": 'Cc1ncc(c(n1)N)C[n+]1csc(c1C)CCOP(=O)(OP(=O)(O)O)O.[Cl-]' "Thallium(III) Trifluoroacetate": '[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[Tl+3]' "Thapsigargin": 'CCCCCCCC(=O)OC1C(OC(=O)C(=CC)C)C(=C2C1C(C)(OC(=O)C)CC(C1(C2OC(=O)C1(C)O)O)OC(=O)CCC)C' "Theobromine": 'Cn1cnc2c1c(=O)[nH]c(=O)n2C' "Theophylline": 'Cn1c(=O)n(C)c2c(c1=O)[nH]cn2' "Thiabendazole": 'c1scc(n1)c1nc2c([nH]1)cccc2' "Thienorphine": 'COC12CCC3(CC1C(CCc1cccs1)(O)C)C14C2Oc2c4c(CC3N(CC1)CC1CC1)ccc2O' "Thioacetic Acid": 'CC(=S)O' "Thioglycolic Acid": 'OC(=O)CS' "Thionyl Chloride": 'ClS(=O)Cl' "Thiophosphoryl Chloride": 'OP(=S)(Cl)O' "Thiovit": 'S' "Thiram": 'CN(C(=S)SSC(=S)N(C)C)C' "Thr": 'C[C@H]([C@@H](C(=O)O)N)O' "Threonine": 'CC(C(C(=O)O)N)O' "Thulium": '[Tm]' "Thulium(III) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Tm+3]' "Thy": 'Cc1c[nH]c(=O)[nH]c1=O' "Thymidine": 'OCC1OC(CC1O)n1cc(C)c(=O)[nH]c1=O' "Thymidylate": 'OC1CC(OC1COP(=O)(O)O)n1cc(C)c(=O)[nH]c1=O' "Thymol": 'Cc1ccc(c(c1)O)C(C)C' "Thyroxine": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "Ti": '[Ti]' "Ti(OH)4": '[Ti+4].[OH-].[OH-].[OH-].[OH-]' "TiCl2": 'Cl[Ti+2]Cl' "TiCl2 iPrO-": '[O-]C(C)C.[O-]C(C)C.Cl[Ti+2]Cl' "TiCl4": '[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]' "TiI": 'CC(Oc1cncc(c1)N1CCC2(C1)CCCN2C)C' "TiO2": '[O-2].[O-2].[Ti+4]' "Tiagabine": 'OC(=O)C1CCCN(C1)CCC=C(c1sccc1C)c1sccc1C' "Tibolone": 'C#CC1(O)CCC2C1(C)CCC1C2C(C)CC2=C1CCC(=O)C2' "Ticlopidine": 'Clc1ccccc1CN1CCc2c(C1)ccs2' "Tigecycline": 'O=C(Nc1cc(N(C)C)c2c(c1O)C(=C1C(C2)CC2C(C1=O)(O)C(=C(C(=O)C2N(C)C)C(=O)N)O)O)CNC(C)(C)C' "Tin(II) 2-Ethylhexanoate": 'CCCCC(C(=O)[O-])CC.CCCCC(C(=O)[O-])CC.[Sn+2]' "Tin(II) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Sn+2]' "Tin(IV) Chloride": '[Cl-].[Cl-].[Cl-].[Cl-].[Sn+4]' "Tirucallane": 'CC(CCCC(C1CCC2(C1(C)CCC1C2CCC2C1(C)CCCC2(C)C)C)C)C' "Titanium": '[Ti]' "Titanium(IV) Chloride": '[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]' "Tm": '[Tm]' "Tmse": '[CH2]C[Si](C)(C)C' "Tnp": '[O-][N+](=O)C1=CC(=[C]C(=C1)[N+](=O)[O-])[N+](=O)[O-]' "Tol": 'COc1ccc2c(c1C(F)(F)F)cccc2C(=S)N(CC(=O)O)C' "Tolbutamide": 'CCCCNC(=O)NS(=O)(=O)c1ccc(cc1)C' "Toluene": 'Cc1ccccc1' "Toluol": 'Cc1ccccc1' "Toluquinol": 'Oc1ccc(c(c1)C)O' "Tomatidine": 'CC1CCC2(NC1)OC1C(C2C)C2(C(C1)C1CCC3C(C1CC2)(C)CCC(C3)O)C' "TosMIC": 'Cc1ccc(cc1)S(=O)(=O)C[N+]#[C-]' "TosylCl": 'Cc1ccc(cc1)S(=O)(=O)Cl' "TosylOH": 'Cc1ccc(cc1)S(=O)(=O)O' "Transcutol": 'OCCOCCOCC' "Tri": 'ClC=C(Cl)Cl' "Tri(2-furyl)phosphine": 'c1coc(c1)P(c1ccco1)c1ccco1' "Tri(2-thienyl)phosphine": 'c1csc(c1)P(c1cccs1)c1cccs1' "Tri(cyclohexa-2,5-dien-1-yl)silane": 'C1=CC(C=CC1)[SiH](C1C=CCC=C1)C1C=CCC=C1' "Tri(m-tolyl)phosphine": 'Cc1cccc(c1)P(c1cccc(c1)C)c1cccc(c1)C' "Tri(o-tolyl)phosphine": 'Cc1ccccc1P(c1ccccc1C)c1ccccc1C' "Tri(p-tolyl)phosphine": 'Cc1ccc(cc1)P(c1ccc(cc1)C)c1ccc(cc1)C' "Tri-n-octylphosphine": 'CCCCCCCCP(CCCCCCCC)CCCCCCCC' "Tri-n-octylphosphine Oxide": 'CCCCCCCCP(=O)(CCCCCCCC)CCCCCCCC' "Tri-tert-butyl 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetate": '[O-]C(=O)CN1CCN(CCN(CCN(CC1)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C' "Tri-tert-butyl 1,4,7,10-Tetraazacyclododecane-1,4,7-triacetate": 'O=C(OC(C)(C)C)CN1CCN(CCNCCN(CC1)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C' "Tri-tert-butylphosphonium Tetrafluoroborate": 'CC([PH+](C(C)(C)C)C(C)(C)C)(C)C.F[B-](F)(F)F' "Triacetoxyethylsilane": 'CC[Si](OC(=O)C)(OC(=O)C)OC(=O)C' "Triallyl(methyl)silane": 'C=CC[Si](CC=C)(CC=C)C' "Triallyl(phenyl)silane": 'C=CC[Si](c1ccccc1)(CC=C)CC=C' "Tribenzylsilane": 'c1ccc(cc1)C[SiH](Cc1ccccc1)Cc1ccccc1' "Tribromoacetic Acid": 'OC(=O)C(Br)(Br)Br' "Tributyl(2-methoxyethyl)phosphonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCC[P+](CCOC)(CCCC)CCCC' "Tributyl(cyanomethyl)phosphonium Chloride": 'CCCC[P+](CC#N)(CCCC)CCCC.[Cl-]' "Tributyl(ethyl)phosphonium Diethyl Phosphate": 'CCOP(=O)(OCC)[O-].CCCC[P+](CCCC)(CCCC)CC' "Tributyl(methyl)ammonium Dicyanamide": 'CCCC[N+](CCCC)(CCCC)C.[N-]=C=NC#N' "Tributyl-n-octylphosphonium Bromide": 'CCCCCCCC[P+](CCCC)(CCCC)CCCC.[Br-]' "Tributylamine": 'CCCCN(CCCC)CCCC' "Tributylchlorosilane": 'CCCC[Si](CCCC)(CCCC)Cl' "Tributyldodecylphosphonium Bromide": 'CCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.[Br-]' "Tributylhexadecylphosphonium Bromide": 'CCCCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.[Br-]' "Tributylmethylammonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCC[N+](CCCC)(CCCC)C' "Tributylmethylammonium Chloride": 'CCCC[N+](CCCC)(CCCC)C.[Cl-]' "Tributylmethylphosphonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCCC[P+](CCCC)(CCCC)C' "Tributylmethylphosphonium Iodide": 'CCCC[P+](CCCC)(CCCC)C.[I-]' "Tributylphosphine Oxide": 'CCCCP(=O)(CCCC)CCCC' "Tributylsilane": 'CCCC[SiH](CCCC)CCCC' "Tributylsulfonium Iodide": 'CCCC[S+](CCCC)CCCC.[I-]' "Tricarbonyl(cyclooctatetraene)iron": 'C1=CC=CC=CC=C1.[C]=O.[C]=O.[C]=O.[Fe]' "Trichloro(3,3,3-trifluoropropyl)silane": 'FC(CC[Si](Cl)(Cl)Cl)(F)F' "Trichloro-2-cyanoethylsilane": 'N#CCC[Si](Cl)(Cl)Cl' "Trichloroacetic Acid": 'OC(=O)C(Cl)(Cl)Cl' "Trichlorocyclopentylsilane": 'Cl[Si](C1CCCC1)(Cl)Cl' "Trichloroisocyanuric Acid": 'O=c1n(Cl)c(=O)n(c(=O)n1Cl)Cl' "Trichloromethanesulfonyl Chloride": 'ClS(=O)(=O)C(Cl)(Cl)Cl' "Tricin": 'COc1cc(cc(c1O)OC)c1cc(=O)c2c(o1)cc(cc2O)O' "Triclosan": 'Clc1ccc(c(c1)O)Oc1ccc(cc1Cl)Cl' "Tricyclohexylphosphine": 'C1CCC(CC1)P(C1CCCCC1)C1CCCCC1' "Tricyclohexylphosphonium Tetrafluoroborate": 'C1CCC(CC1)[PH+](C1CCCCC1)C1CCCCC1.F[B-](F)(F)F' "Triethoxy(3-glycidyloxypropyl)silane": 'CCO[Si](OCC)(OCC)CCCOCC1CO1' "Triethoxy(pentafluorophenyl)silane": 'CCO[Si](c1c(F)c(F)c(c(c1F)F)F)(OCC)OCC' "Triethoxy(propyl)silane": 'CCC[Si](OCC)(OCC)OCC' "Triethoxy-1H,1H,2H,2H-tridecafluoro-n-octylsilane": 'CCOC(C(C(C(C(C(CC([SiH2]F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC)OCC' "Triethoxy-n-octylsilane": 'CCCCCCCC[Si](OCC)(OCC)OCC' "Triethoxy[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silane": 'CCO[Si](CCC1CCC2C(C1)O2)(OCC)OCC' "Triethoxyethylsilane": 'CC[Si](OCC)(OCC)OCC' "Triethoxyfluorosilane": 'CCO[Si](OCC)(OCC)F' "Triethoxymethylsilane": 'CCO[Si](OCC)(OCC)C' "Triethoxyphenylsilane": 'CCO[Si](c1ccccc1)(OCC)OCC' "Triethoxyvinylsilane": 'CCO[Si](OCC)(OCC)C=C' "Triethyl 2-Fluoro-2-phosphonoacetate": 'CCOC(=O)C(P(=O)(OCC)OCC)F' "Triethyl(trifluoromethyl)silane": 'CC[Si](C(F)(F)F)(CC)CC' "Triethylamine": 'CCN(CC)CC' "Triethylamine Borane": 'CCN(CC)CC.B' "Triethylamine Trihydrofluoride": 'CCN(CC)CC.F.F.F' "Triethylchlorogermane": 'CC[Ge](CC)(CC)Cl' "Triethylenetetramine": 'NCCNCCNCCN' "Triethylmethylammonium Chloride": 'CC[N+](CC)(CC)C.[Cl-]' "Triethylphenylammonium Chloride": 'CC[N+](c1ccccc1)(CC)CC.[Cl-]' "Triethylsilane": 'CC[SiH](CC)CC' "Triethylsilanol": 'CC[Si](CC)(CC)O' "Triethylsilylacetylene": 'CC[Si](C#C)(CC)CC' "Triethylsulfonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CC[S+](CC)CC' "Triethylvinylsilane": 'CC[Si](C=C)(CC)CC' "Trifluoroacetic Acid": 'OC(=O)C(F)(F)F' "Trifluoroacetic Anhydride": 'O=C(C(F)(F)F)OC(=O)C(F)(F)F' "Trifluoroacetyl Triflate": 'O=C(C(F)(F)F)OS(=O)(=O)C(F)(F)F' "Trifluoroacetylacetone": 'O=C(C(F)(F)F)CC(=O)C' "Trifluoromethanesulfonanilide": 'FC(S(=O)(=O)Nc1ccccc1)(F)F' "Trifluoromethanesulfonic Acid": 'FC(S(=O)(=O)O)(F)F' "Trifluoromethanesulfonic Anhydride": 'FC(S(=O)(=O)OS(=O)(=O)C(F)(F)F)(F)F' "Trifluoromethanesulfonyl Chloride": 'FC(S(=O)(=O)Cl)(F)F' "Trigonelline": 'C[n+]1cccc(c1)C(=O)[O-]' "Trihexyl(tetradecyl)phosphonium Chloride": 'CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.[Cl-]' "Trihexyl(tetradecyl)phosphonium Dicyanamide": 'CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.N#C[N-]C#N' "Trihexylphosphine": 'CCCCCCP(CCCCCC)CCCCCC' "Trihexylsilane": 'CCCCCC[SiH](CCCCCC)CCCCCC' "Triisopropyl[(trimethylsilyl)ethynyl]silane": 'CC([Si](C(C)C)(C(C)C)C#C[Si](C)(C)C)C' "Triisopropylsilane": 'CC([SiH](C(C)C)C(C)C)C' "Triisopropylsilylacetylene": 'CC([Si](C(C)C)(C(C)C)C#C)C' "Trimagnesium Dicitrate Nonahydrate": '[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[Mg+2].[Mg+2].[Mg+2].O.O.O.O.O.O.O.O.O' "Trimethoxy(1H,1H,2H,2H-tridecafluoro-n-octyl)silane": 'CO[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OC)OC' "Trimethoxy(2-phenylethyl)silane": 'CO[Si](CCc1ccccc1)(OC)OC' "Trimethoxy(3,3,3-trifluoropropyl)silane": 'CO[Si](CCC(F)(F)F)(OC)OC' "Trimethoxy(4-methoxyphenyl)silane": 'COc1ccc(cc1)[Si](OC)(OC)OC' "Trimethoxy(methyl)silane": 'CO[Si](OC)(OC)C' "Trimethoxy(phenylethyl)silane": 'CO[Si](CCc1ccccc1)(OC)OC' "Trimethoxy(propyl)silane": 'CCC[Si](OC)(OC)OC' "Trimethoxy-n-octylsilane": 'CCCCCCCC[Si](OC)(OC)OC' "Trimethoxy[3-(methylamino)propyl]silane": 'CNCCC[Si](OC)(OC)OC' "Trimethoxy[3-(phenylamino)propyl]silane": 'CO[Si](CCCNc1ccccc1)(OC)OC' "Trimethoxyphenylsilane": 'CO[Si](c1ccccc1)(OC)OC' "Trimethyl(2-pyridyl)tin": 'C[Sn](c1ccccn1)(C)C' "Trimethyl(4-pyridyl)tin": 'C[Sn](c1ccncc1)(C)C' "Trimethyl(heptafluoropropyl)silane": 'FC(C(C([Si](C)(C)C)(F)F)(F)F)(F)F' "Trimethyl(nonafluorobutyl)silane": 'FC(C(C(C(F)(F)F)(F)F)(F)F)([Si](C)(C)C)F' "Trimethyl(pentafluoroethyl)silane": 'FC(C(F)(F)F)([Si](C)(C)C)F' "Trimethyl(pentafluorophenyl)silane": 'Fc1c(F)c(F)c(c(c1F)[Si](C)(C)C)F' "Trimethyl(tridecafluorohexyl)silane": 'C[Si](C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C)C' "Trimethyl[2-[(trimethylsilyl)methyl]benzyl]ammonium Iodide": 'C[Si](Cc1ccccc1C[N+](C)(C)C)(C)C.[I-]' "Trimethyl[3-(trimethoxysilyl)propyl]ammonium Chloride": 'CO[Si](CCC[N+](C)(C)C)(OC)OC.[Cl-]' "Trimethylamine Borane": 'CN(C)C.B' "Trimethylamine N-Oxide Anhydrous": '[O-][N+](C)(C)C' "Trimethylamine N-Oxide Dihydrate": '[O-][N+](C)(C)C.O.O' "Trimethylchlorogermane": 'C[Ge](Cl)(C)C' "Trimethylethoxysilane": 'CCO[Si](C)(C)C' "Trimethylnonylammonium Bromide": 'CCCCCCCCC[N+](C)(C)C.[Br-]' "Trimethylphenylammonium Bromide": 'C[N+](c1ccccc1)(C)C.[Br-]' "Trimethylphenylammonium Chloride": 'C[N+](c1ccccc1)(C)C.[Cl-]' "Trimethylphenylammonium Hydroxide": 'C[N+](c1ccccc1)(C)C.[OH-]' "Trimethylphenylammonium Tribromide": 'C[N+](c1ccccc1)(C)C.[Br-].[Br-].[Br-]' "Trimethylphenylsilane": 'C[Si](c1ccccc1)(C)C' "Trimethylphosphine": 'CP(C)C' "Trimethylpropylammonium Bis(trifluoromethanesulfonyl)imide": 'FC(S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F)(F)F.CCC[N+](C)(C)C' "Trimethylpropylammonium Bromide": 'CCC[N+](C)(C)C.[Br-]' "Trimethylsilyl Acetate": 'CC(=O)O[Si](C)(C)C' "Trimethylsilyl Difluoro(fluorosulfonyl)acetate": 'O=C(C(S(=O)(=O)F)(F)F)O[Si](C)(C)C' "Trimethylsilyl Propionate": 'CCC(=O)O[Si](C)(C)C' "Trimethylsilyl Trifluoroacetate": 'O=C(C(F)(F)F)O[Si](C)(C)C' "Trimethylsilylacetylene": 'C#C[Si](C)(C)C' "Trimethylsilylcyclopentadiene": 'C[Si](C1=CC=CC1)(C)C' "Trimethylsilylketene Ethyl Trimethylsilyl Acetal": 'CCO/C(=C\[Si](C)(C)C)/O[Si](C)(C)C' "Trimethylsilylmethylmagnesium Chloride": 'Cl[Mg]C[Si](C)(C)C' "Trimethylstearylammonium Bromide": 'CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[Br-]' "Trimethylsulfonium Iodide": 'C[S+](C)C.[I-]' "Trimethyltetradecylammonium Chloride": 'CCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]' "Trimethyltin Chloride": 'C[Sn](Cl)(C)C' "Trioctylmethylammonium Chloride": 'CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C.[Cl-]' "Triparanol": 'CCN(CCOc1ccc(cc1)C(c1ccc(cc1)C)(Cc1ccc(cc1)Cl)O)CC' "Triphenyl Phosphite": 'c1ccc(cc1)OP(Oc1ccccc1)Oc1ccccc1' "Triphenylantimony": 'c1ccc(cc1)[Sb](c1ccccc1)c1ccccc1' "Triphenylantimony Diacetate": 'c1ccc(cc1)[Sb](c1ccccc1)c1ccccc1.CC(=O)O.CC(=O)O' "Triphenylantimony Dichloride": 'Cl[Sb](c1ccccc1)(c1ccccc1)(c1ccccc1)Cl' "Triphenylantimony Oxide": 'O=[Sb](c1ccccc1)(c1ccccc1)c1ccccc1' "Triphenylarsine": 'c1ccc(cc1)[As](c1ccccc1)c1ccccc1' "Triphenylchlorogermane": 'Cl[Ge](c1ccccc1)(c1ccccc1)c1ccccc1' "Triphenylphosphine": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1' "Triphenylphosphine Borane": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.B' "Triphenylphosphine Oxide": 'O=P(c1ccccc1)(c1ccccc1)c1ccccc1' "Triphenylphosphine Selenide": '[Se]=P(c1ccccc1)(c1ccccc1)c1ccccc1' "Triphenylsilane": 'c1ccc(cc1)[SiH](c1ccccc1)c1ccccc1' "Triphenylsilanol": 'O[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "Triphenylvinylsilane": 'C=C[Si](c1ccccc1)(c1ccccc1)c1ccccc1' "Triphosgene": 'O=C(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl' "Triptolide": 'O=C1OCC2=C1CCC1(C2CC2C3(C41OC4C1OC1(C3O)C(C)C)O2)C' "Triptorelin": 'OCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1CCCC1C(=O)NCC(=O)N)CCCN=C(N)N)CC(C)C)Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O)NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C1CCC(=O)N1)Cc1[nH]cnc1' "Tris(1-pyrazolyl)methane": 'c1cnn(c1)C(n1cccn1)n1cccn1' "Tris(2,2'-bipyridyl)ruthenium(II) Chloride Hexahydrate": 'c1ccc(nc1)c1ccccn1.c1ccc(nc1)c1ccccn1.c1ccc(nc1)c1ccccn1.[Cl-].[Cl-].[Ru+2].O.O.O.O.O.O' "Tris(2,4-di-tert-butylphenyl) Phosphite": 'CC(c1cc(ccc1OP(Oc1ccc(cc1C(C)(C)C)C(C)(C)C)Oc1ccc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)(C)C' "Tris(2,4-pentanedionato)cobalt(III)": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Co+3]' "Tris(2,4-pentanedionato)iron(III)": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Fe+3]' "Tris(2,4-pentanedionato)manganese(III)": '[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Mn+3]' "Tris(2,6-dimethoxyphenyl)phosphine": 'COc1cccc(c1P(c1c(OC)cccc1OC)c1c(OC)cccc1OC)OC' "Tris(2-aminoethyl)amine": 'NCCN(CCN)CCN' "Tris(2-benzimidazolylmethyl)amine": 'c1ccc2c(c1)[nH]c(n2)CN(Cc1nc2c([nH]1)cccc2)Cc1nc2c([nH]1)cccc2' "Tris(2-carboxyethyl)phosphine Hydrochloride": 'OC(=O)CCP(CCC(=O)O)CCC(=O)O.Cl' "Tris(2-methoxyphenyl)phosphine": 'COc1ccccc1P(c1ccccc1OC)c1ccccc1OC' "Tris(2-phenylpyridinato)iridium(III)": 'c1ccc(cc1)c1ccccn1.c1ccc(cc1)c1ccccn1.c1ccc(cc1)c1ccccn1.[Ir]' "Tris(2-pyridylmethyl)amine": 'c1ccc(nc1)CN(Cc1ccccn1)Cc1ccccn1' "Tris(3,5-dimethyl-1-pyrazolyl)methane": 'Cc1cc(nn1C(n1nc(cc1C)C)n1nc(cc1C)C)C' "Tris(3-hydroxypropyltriazolylmethyl)amine": 'OCCCC(c1nn[nH]c1)N(C(c1nn[nH]c1)CCCO)C(c1nn[nH]c1)CCCO' "Tris(4-fluorophenyl)phosphine": 'Fc1ccc(cc1)P(c1ccc(cc1)F)c1ccc(cc1)F' "Tris(4-methoxyphenyl)phosphine": 'COc1ccc(cc1)P(c1ccc(cc1)OC)c1ccc(cc1)OC' "Tris(dibenzoylmethanato) Iron": '[O-]/C(=C\C(=O)c1ccccc1)/c1ccccc1.[O-]/C(=C\C(=O)c1ccccc1)/c1ccccc1.[O-]/C(=C\C(=O)c1ccccc1)/c1ccccc1.[Fe+3]' "Tris(dibenzylideneacetone)dipalladium(0)": 'O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.O=C(/C=C/c1ccccc1)/C=C/c1ccccc1.[Pd].[Pd]' "Tris(diethylamino)phosphine": 'CCN(P(N(CC)CC)N(CC)CC)CC' "Tris(hydroxymethyl)aminomethane": 'OCC(CO)(CO)N' "Tris(pentafluorophenyl)phosphine": 'Fc1c(P(c2c(F)c(F)c(c(c2F)F)F)c2c(F)c(F)c(c(c2F)F)F)c(F)c(c(c1F)F)F' "Tris(trimethylsilyloxy)silane": 'C[Si](O[SiH](O[Si](C)(C)C)O[Si](C)(C)C)(C)C' "Tris(triphenylphosphine)rhodium(I) Chloride": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Cl-].[Rh+]' "Tris(triphenylphosphine)ruthenium(II) Dichloride": 'c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Ru+2]' "Tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine": 'c1ccc(cc1)Cn1nnc(c1)CN(Cc1nnn(c1)Cc1ccccc1)Cc1nnn(c1)Cc1ccccc1' "Tris[2-(dimethylamino)ethyl]amine": 'CN(CCN(CCN(C)C)CCN(C)C)C' "Tris[3,5-bis(trifluoromethyl)phenyl]phosphine": 'FC(c1cc(cc(c1)C(F)(F)F)P(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(F)F' "Trisodium Paraperiodate": '[O-][I](=O)(O)(O)([O-])[O-].[Na+].[Na+].[Na+]' "Troc": 'ClCC(O[C]=O)(Cl)Cl' "Trolox": 'Cc1c2OC(C)(CCc2c(c(c1C)O)C)C(=O)O' "Tropane": 'CN1C2CCCC1CC2' "Trp": 'OC(=O)[C@H](Cc1c[nH]c2c1cccc2)N' "Trp-P-1": 'Nc1nc(C)c2c(c1C)[nH]c1c2cccc1' "Trp-P-2": 'Nc1nc(C)c2c(c1)[nH]c1c2cccc1' "Tryptamine": 'NCCc1c[nH]c2c1cccc2' "Tryptanthrin": 'O=C1c2nc3ccccc3c(=O)n2-c2c1cccc2' "Tryptophan": 'OC(=O)C(Cc1c[nH]c2c1cccc2)N' "TsCl": 'Cc1ccc(cc1)S(=O)(=O)Cl' "TsOH": 'Cc1ccc(cc1)S(=O)(=O)O' "Tse": '[CH2]C[Si](C)(C)C' "Tungsten": '[W]' "TxA2": 'CCCCCC(C=CC1OC2CC(C1CC=CCCCC(=O)O)O2)O' "TxB2": 'CCCCCC(C=CC1OC(O)CC(C1CC=CCCCC(=O)O)O)O' "Tyr": 'OC(=O)[C@H](Cc1ccc(cc1)O)N' "Tyramine": 'NCCc1ccc(cc1)O' "Tyrosin": 'OC(=O)C(Cc1ccc(cc1)O)N' "Tyrosine": 'OC(=O)C(Cc1ccc(cc1)O)N' "UDCA": 'OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)O)C)C)O)C' "UDP": 'OC1C(COP(=O)(OP(=O)(O)O)O)OC(C1O)n1ccc(=O)[nH]c1=O' "UDPGA": 'OC1C(COP(=O)(OP(=O)(OC2OC(C(=O)O)C(C(C2O)O)O)O)O)OC(C1O)n1ccc(=O)[nH]c1=O' "URE": 'NC(=O)N' "Uracil": 'O=c1cc[nH]c(=O)[nH]1' "Urea": 'NC(=O)N' "Uridine": 'OCC1OC(C(C1O)O)n1ccc(=O)[nH]c1=O' "V2O5": 'O=[V](=O)O[V](=O)=O' "VA": 'CC(=O)OC=C' "VAL": 'N[C@H](C(=O)O)C(C)C' "VAP": 'COc1c(OC)c(OC)cc2c1n(C)c(=O)cc2C' "VAZO": 'N#CC1(CCCCC1)/N=N/C1(CCCCC1)C#N' "VB": 'CCCC(=O)OC=C' "VCH": 'C=CC1=CCCCC1' "VCM": 'ClC=C' "VCl4": 'Cl[V](Cl)(Cl)Cl' "VIN": 'O=CN1c2cc(OC)c(cc2C23C1C(O)(C(=O)OC)C(OC(=O)C)C1(C3N(CC2)CC=C1)CC)C1(CC2CN(CCc3c1[nH]c1c3cccc1)CC(C2)(O)CC)C(=O)OC' "VMA": 'COc1cc(ccc1O)C(C(=O)O)O' "VOC-Cl": 'ClC(=O)OC=C' "VPA": 'CCCC(C(=O)O)CCC' "VPD": 'CCCC(C(=O)N)CCC' "Val": 'N[C@H](C(=O)O)C(C)C' "Val-Pro-Pro": 'CC(C(C(=O)N1CCCC1C(=O)N1CCCC1C(=O)O)N)C' "Valacyclovir": 'CC(C(C(=O)OCCOCn1cnc2c1[nH]c(N)nc2=O)N)C' "Valdoxan": 'COc1ccc2c(c1)c(CCNC(=O)C)ccc2' "Valine": 'NC(C(=O)O)C(C)C' "Valpromide": 'CCCC(C(=O)N)CCC' "Vanadium": '[V]' "Vancomycin": 'OCC1OC(Oc2c3cc4cc2Oc2ccc(cc2Cl)C(O)C2NC(=O)C(NC(=O)C4NC(=O)C(CC(=O)N)NC(=O)C(C(c4ccc(O3)c(Cl)c4)O)NC(=O)C(CC(C)C)NC)c3ccc(c(-c4c(O)cc(cc4C(NC2=O)C(=O)O)O)c3)O)C(C(C1O)O)OC1OC(C)C(C(C1)(C)N)O' "Vandetanib": 'COc1cc2c(ncnc2cc1OCC1CCN(CC1)C)Nc1ccc(cc1F)Br' "Vanillin": 'COc1cc(C=O)ccc1O' "Vardenafil": 'CCOc1ccc(cc1c1nc(=O)c2n([nH]1)c(CCC)nc2C)S(=O)(=O)N1CCN(CC1)CC' "Vegfrecine": 'NC(=O)C1=C(N)C(=O)C=C(C1=O)Nc1ccccc1O' "Velcade": 'CC(CC(B(O)O)NC(=O)C(NC(=O)c1cnccn1)Cc1ccccc1)C' "Vemurafenib": 'CCCS(=O)(=O)Nc1ccc(c(c1F)C(=O)c1c[nH]c2c1cc(cn2)c1ccc(cc1)Cl)F' "Venlafaxine": 'COc1ccc(cc1)C(C1(O)CCCCC1)CN(C)C' "Vernakalant": 'COc1cc(CCOC2CCCCC2N2CCC(C2)O)ccc1OC' "Vesnarinone": 'COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc2c(c1)CCC(=O)N2' "Vilanterol": 'OCc1cc(ccc1O)C(CNCCCCCCOCCOCc1c(Cl)cccc1Cl)O' "Vin": 'O=CN1c2cc(OC)c(cc2C23C1C(O)(C(=O)OC)C(OC(=O)C)C1(C3N(CC2)CC=C1)CC)C1(CC2CN(CCc3c1[nH]c1c3cccc1)CC(C2)(O)CC)C(=O)OC' "Vinclozolin": 'C=CC1(C)OC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl' "Vinylmagnesium Bromide": 'Br[Mg]C=C' "Vinyltrimethoxysilane": 'CO[Si](C=C)(OC)OC' "Vinyltrimethylsilane": 'C=C[Si](C)(C)C' "Vinyltris(2-methoxyethoxy)silane": 'COCCO[Si](OCCOC)(OCCOC)C=C' "Vizantin": 'CCCCCCCCCC(CC(=O)OCC1OC(OC2OC(COC(=O)CC(CCCCCCCCC)CCCCCCCCC)C(C(C2O)O)O)C(C(C1O)O)O)CCCCCCCCC' "Volinanserin": 'COc1cccc(c1OC)C(C1CCN(CC1)CCc1ccc(cc1)F)O' "Voriconazole": 'Fc1ccc(c(c1)F)C(C(c1ncncc1F)C)(Cn1cncn1)O' "Votrient": 'CN(c1ccc2c(c1)nn(c2C)C)c1ccnc(n1)Nc1ccc(c(c1)S(=O)(=O)N)C.Cl' "WC": 'SCC(C(=O)O)NC(=O)C(Cc1c[nH]c2c1cccc2)N' "Warfarin": 'CC(=O)CC(c1c(=O)oc2c(c1O)cccc2)c1ccccc1' "Wogonin": 'COc1c(O)cc(c2c1oc(cc2=O)c1ccccc1)O' "Wortmannin": 'COCC1OC(=O)c2c3C1(C)C1=C(C(=O)c3oc2)C2C(CC1OC(=O)C)(C)C(=O)CC2' "Wst-1": 'Ic1ccc(cc1)[n+]1nc(nn1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]' "X-Phos": 'CC(c1cc(cc(c1c1ccccc1P(C1CCCCC1)C1CCCCC1)C(C)C)C(C)C)C' "XAC": 'CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN' "XPhos": 'CC(c1cc(cc(c1c1ccccc1P(C1CCCCC1)C1CCCCC1)C(C)C)C(C)C)C' "Xalkori": 'Nc1ncc(cc1OC(c1c(Cl)ccc(c1Cl)F)C)c1cnn(c1)C1CCNCC1' "Xanthohumol": 'COc1cc(O)c(c(c1C(=O)C=Cc1ccc(cc1)O)O)CC=C(C)C' "Xantphos": 'CC1(C)c2cccc(c2Oc2c1cccc2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1' "Xe": '[Xe]' "Xe4": 'OC1CC(O)C(=C)C(=CC=C2CCCC3(C2CCC3C#CC#CC(O)(C)C)C)C1' "Xyl": 'OC1COC(C(C1O)O)O' "Y": '[Y]' "YSZ": 'O=[Y]O[Y]=O.O=[Zr]=O' "Yb": '[Yb]' "Yohimbine": 'COC(=O)C1C(O)CCC2C1CC1N(C2)CCc2c1[nH]c1c2cccc1' "Ytterbium": '[Yb]' "Ytterbium(III) Trifluoromethanesulfonate Hydrate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Yb+3].O' "Yttrium": '[Y]' "Yttrium(III) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Y+3]' "Z-DEVD-fmk": 'COC(=O)CCC(C(=O)NC(C(=O)NC(C(=O)CF)CC(=O)OC)C(C)C)NC(=O)C(NC(=O)OCc1ccccc1)CC(=O)OC' "Z-Leu-Leu-Leu-al": 'O=CC(NC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C)CC(C)C' "ZDV": 'OCC1OC(CC1N=[N+]=[N-])n1cc(C)c(=O)[nH]c1=O' "ZEA": 'OCC(=CCN=C1N=CN=C2C1=NC=N2)C' "ZNPP": 'C=CC1=C(C)C2=CC3=NC(=Cc4[n-]c(C=c5[n-]c(=CC1=N2)c(C)c5CCC(=O)O)c(CCC(=O)O)c4C)C(=C3C=C)C.[Zn+2]' "ZVI": '[Fe]' "Zaleplon": 'CCN(c1cccc(c1)c1ccnc2n1ncc2C#N)C(=O)C' "Zanamivir": 'OCC(C(C1OC(=CC(C1NC(=O)C)N=C(N)N)C(=O)O)O)O' "Zearalenone": 'CC1CCCC(=O)CCCC=Cc2c(C(=O)O1)c(O)cc(c2)O' "Zinc Bromide": '[Zn+2].[Br-].[Br-]' "Zinc Chloride": '[Cl-].[Cl-].[Zn+2]' "Zinc(II) Bis(trifluoromethanesulfinate) Dihydrate": 'FC(S(=O)[O-])(F)F.FC(S(=O)[O-])(F)F.[Zn+2].O.O' "Zinc(II) Trifluoromethanesulfonate": 'FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.[Zn+2]' "Ziprasidone": 'O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2' "Zirconium": '[Zr]' "Zirconocene Chloride Hydride": '[Del][Zr+2][Del].c1cccc1.c2cccc2.[Cl-].[H-]' "Zn": '[Zn]' "Zn(OH)2": '[Zn+2].[OH-].[OH-]' "ZnBr2": '[Zn+2].[Br-].[Br-]' "ZnCl2": '[Cl-].[Cl-].[Zn+2]' "ZnFe2O4": 'O[Fe]=O.O[Fe]=O.[Zn]' "ZnO": 'O=[Zn]' "ZnO2": '[O-][O-].[Zn+2]' "ZnPP": 'C=CC1=C(C)C2=CC3=NC(=Cc4[n-]c(C=c5[n-]c(=CC1=N2)c(C)c5CCC(=O)O)c(CCC(=O)O)c4C)C(=C3C=C)C.[Zn+2]' "ZnSO4": '[O-]S(=O)(=O)[O-].[Zn+2]' "ZnSe": '[Zn]=[Se]' "Zno": 'O=[Zn]' "Zr": '[Zr]' "Zr(OH)4": '[Zr+4].[OH-].[OH-].[OH-].[OH-]' "ZrO2": 'O=[Zr]=O' "[(4-Bromobenzyl)oxy](tert-butyl)dimethylsilane": 'CC([Si](OCc1ccc(cc1)Br)(C)C)(C)C' "[(4-Methoxyphenyl)ethynyl]trimethylsilane": 'COc1ccc(cc1)C#C[Si](C)(C)C' "[(R)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl]ruthenium(II) Dichloride": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1.[Cl-].[Cl-].[Ru+2]' "[(S)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl]ruthenium(II) Dichloride": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1.[Cl-].[Cl-].[Ru+2]' "[1,1'-Bis(diphenylphosphino)ferrocene]cobalt(II) Dichloride": '[Del][Fe][Del].C1(P(c2cccc2)C3=CC=CC=C3)=CC=CC=C1.C4(P(c5cccc5)C6=CC=CC=C6)=CC=CC=C4.[Co+2].[Cl-].[Cl-]' "[1,1'-Bis(diphenylphosphino)ferrocene]nickel(II) Dichloride": '[Del][Fe][Del].P(C1=CC=CC=C1)(c2cccc2)C3=CC=CC=C3.P(C4=CC=CC=C4)(c5cccc5)C6=CC=CC=C6.[Ni+2].[Cl-].[Cl-]' "[1,2-Bis(diphenylphosphino)ethane]nickel(II) Dichloride": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Ni+2]' "[1,2-Bis(diphenylphosphino)ethane]palladium(II) Dichloride": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Pd+2]' "[1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene]triphenylphosphine Nickel(II) Dichloride": 'CC(c1cccc(c1n1ccn(c1=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1c(cccc1C(C)C)C(C)C)C(C)C)C.[Cl-].[Cl-].[Ni+2]' "[1,3-Bis(diphenylphosphino)propane]nickel(II) Dichloride": 'C(CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Ni+2]' "[12]aneN4": 'N1CCNCCNCCNCC1' "[12]aneS4": 'S1CCSCCSCCSCC1' "[14]1,3-dieneN4": 'N1CCNCCC/N=C/C=N/CCC1' "[14]aneN4": 'C1CNCCNCCCNCCNC1' "[18]aneP4O2": 'C1OCCPCCPCCOCCPCCPC1' "[3-(6-Aminohexylamino)propyl]trimethoxysilane": 'NCCCCCCNCCC[Si](OC)(OC)OC' "[3-(Diethylamino)propyl]trimethoxysilane": 'CCN(CCC[Si](OC)(OC)OC)CC' "[3-(N,N-Dimethylamino)propyl]trimethoxysilane": 'CO[Si](CCCN(C)C)(OC)OC' "[3-(Trimethoxysilyl)propyl]succinic Anhydride": 'CO[Si](CCCC1CC(=O)OC1=O)(OC)OC' "[9]aneN3": 'N1CCNCCNCC1' "[9]aneS3": 'S1CCSCCSCC1' "[Bis(trifluoroacetoxy)iodo]pentafluorobenzene": 'O=C(C(F)(F)F)O[I](c1c(F)c(F)c(c(c1F)F)F)OC(=O)C(F)(F)F' "[Di-tert-butyl(chloro)phosphine]palladium(II) Dichloride": 'ClP(C(C)(C)C)C(C)(C)C.[Cl-].[Cl-].[Pd+2]' "[Hydroxy(tosyloxy)iodo]benzene": 'Cc1ccc(cc1)S(=O)(=O)O[I](c1ccccc1)O' "[bpy]": 'CCCC[n+]1cccnc1' "[hmim]BF4": 'F[B-](F)(F)F.CCCCCCn1cc[n+](c1)C' "[hmim]Cl": 'CCCCCCn1cc[n+](c1)C.[Cl-]' "[hmim]PF6": 'F[P-](F)(F)(F)(F)F.CCCCCCn1cc[n+](c1)C' "[tmba]": 'CCCC[N+](C)(C)C' "aaptamine": 'COc1cc2C=CNc3c2c(c1OC)ncc3' "abacavir": 'OCC1C=CC(C1)n1cnc2c1nc(N)nc2NC1CC1' "abediterol": 'O=c1ccc2c([nH]1)c(O)ccc2C(CNCCCCCCOCC(c1ccccc1)(F)F)O' "abietane": 'CC(C1CCC2C(C1)CCC1C2(C)CCCC1(C)C)C' "abiraterone": 'OC1CCC2(C(=CCC3C2CCC2(C3CC=C2c2cccnc2)C)C1)C' "acac": 'CC(=O)CC(=O)C' "acacetin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2O)O' "acamprosate": 'CC(=O)NCCCS(=O)(=O)O' "acebutolol": 'CCCC(=O)Nc1ccc(c(c1)C(=O)C)OCC(CNC(C)C)O' "acenaphthene": 'c1cc2cccc3c2c(c1)CC3' "acenaphthylene": 'c1cc2cccc3c2c(c1)C=C3' "acenocoumarol": 'CC(=O)CC(c1c(=O)oc2c(c1O)cccc2)c1ccc(cc1)[N+](=O)[O-]' "acephate": 'COP(=O)(NC(=O)C)SC' "acetaminophen": 'CC(=O)Nc1ccc(cc1)O' "acetazolamide": 'CC(=O)Nc1nnc(s1)S(=O)(=O)N' "acetoin": 'CC(=O)C(O)C' "acetone": 'CC(=O)C' "acetophenone": 'CC(=O)c1ccccc1' "achyrofuran": 'CCC(C(=O)c1c(O)c(CC(C(=C)C)O)c2c(c1O)c1c(O)c(CC=C(C)C)c(c(c1o2)C(=O)C(CC)C)O)C' "aciclovir": 'Nc1nc(=O)c2c([nH]1)n(COCCO)cn2' "acitretin": 'COc1cc(C)c(c(c1C)C)C=CC(=CC=CC(=CC(=O)O)C)C' "acridine": 'c1ccc2c(c1)nc1c(c2)cccc1' "acrolein": 'C=CC=O' "acrylamide": 'NC(=O)C=C' "acteoside": 'OCC1OC(OCCc2ccc(c(c2)O)O)C(C(C1OC(=O)C=Cc1ccc(c(c1)O)O)OC1OC(C)C(C(C1O)O)O)O' "actinomycin-D": 'O=C1NC(C(C)C)C(=O)N2CCCC2C(=O)N(C)CC(=O)N(C(C(=O)OC(C1NC(=O)c1c2-c(oc3c(n2)c(ccc3C)C(=O)NC2C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C(=O)C3N(C(=O)C(NC2=O)C(C)C)CCC3)C)c(c(=O)c1N)C)C)C(C)C)C' "actinorhodin": 'OC(=O)CC1OC(C)c2c(C1)c(O)c1c(c2O)C(=O)C(=CC1=O)C1=CC(=O)c2c(C1=O)c(O)c1c(c2O)CC(OC1C)CC(=O)O' "acyclovir": 'Nc1nc(=O)c2c([nH]1)n(COCCO)cn2' "adamantane": 'C1C2CC3CC1CC(C2)C3' "adamantine": 'C1C2CC3CC1CC(C2)C3' "ade": 'Nc1ncnc2c1[nH]cn2' "adefovir": 'Nc1ncnc2c1ncn2CCOCP(=O)(O)O' "adenine": 'Nc1ncnc2c1[nH]cn2' "adenosine": 'OCC1OC(C(C1O)O)n1cnc2c1ncnc2N' "adenosylhomocysteine": 'OC(=O)C(CCSCC1OC(C(C1O)O)n1cnc2c1ncnc2N)N' "adenylate": 'OC1C(O)C(OC1n1cnc2c1ncnc2N)COP(=O)(O)O' "ado": 'OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N' "adrenaline": 'CNCC(c1ccc(c(c1)O)O)O' "adriamycin": 'OCC(=O)C1(O)CC(OC2CC(N)C(C(O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC' "aerugidiol": 'CC(=C1CC2C(C)(O)CCC2(C(=CC1=O)C)O)C' "afatinib": 'CN(CC=CC(=O)Nc1cc2c(ncnc2cc1OC1COCC1)Nc1ccc(c(c1)Cl)F)C' "afloqualone": 'FCc1nc2ccc(cc2c(=O)n1c1ccccc1C)N' "afzelin": 'Oc1ccc(cc1)c1oc2cc(O)cc(c2c(=O)c1OC1OC(C)C(C(C1O)O)O)O' "agmatine": 'NCCCCN=C(N)N' "agomelatine": 'COc1ccc2c(c1)c(CCNC(=O)C)ccc2' "ajmalicine": 'COC(=O)C1=COC(C2C1CC1N(C2)CCc2c1[nH]c1c2cccc1)C' "ajoene": 'C=CCSSC=CCS(=O)CC=C' "ajugol": 'OCC1OC(OC2OC=CC3C2C(C)(O)CC3O)C(C(C1O)O)O' "alaproclate": 'CC(C(=O)OC(Cc1ccc(cc1)Cl)(C)C)N' "albendazole": 'CCCSc1ccc2c(c1)[nH]c(n2)NC(=O)OC' "albuterol": 'OCc1cc(ccc1O)C(CNC(C)(C)C)O' "aldosterone": 'OCC(=O)C1CCC2C1(C=O)CC(O)C1C2CCC2=CC(=O)CCC12C' "aldrin": 'ClC1=C(Cl)C2(C(C1(Cl)C1C2C2CC1C=C2)(Cl)Cl)Cl' "alendronate": 'NCCCC(P(=O)(O)O)(P(=O)(O)O)O' "alfentanil": 'COCC1(CCN(CC1)CCn1nnn(c1=O)CC)N(c1ccccc1)C(=O)CC' "allicin": 'C=CCSS(=O)CC=C' "alloferon": 'OCC(C(=O)NCC(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NCC(=O)O)Cc1[nH]cnc1)C(C)C)Cc1[nH]cnc1)CCC(=O)N)Cc1[nH]cnc1)NC(=O)C(C(C)C)NC(=O)CNC(=O)C(Cc1[nH]cnc1)N' "allopurinol": 'O=c1ncnc2-c1c[nH][nH]2' "allotetrahydrodeoxycorticosterone": 'OCC(=O)C1CCC2C1(C)CCC1C2CCC2C1(C)CCC(C2)O' "alloxan": 'O=C1NC(=O)C(=O)C(=O)N1' "allyl bromide": 'BrCC=C' "allyl chloride": 'ClCC=C' "allyl iodide": 'ICCC=C' "almorexant": 'CNC(=O)C(N1CCc2c(C1CCc1ccc(cc1)C(F)(F)F)cc(c(c2)OC)OC)c1ccccc1' "alnumycin": 'CCCC1OC(=Cc2c1c(O)c1c(c2)C(=O)C=C(C1=O)C1OCC(C(O1)CO)O)C' "aloe-emodin": 'OCc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)ccc1' "alogliptin": 'N#Cc1ccccc1Cn1c(cc(=O)n(c1=O)C)N1CCCC(C1)N' "alpha-tocopherol": 'CC(CCCC1(C)CCc2c(O1)c(C)c(c(c2C)O)C)CCCC(CCCC(C)C)C' "alprazolam": 'Clc1ccc2-n3c(CN=C(c2c1)c1ccccc1)nnc3C' "alstovenine": 'COC(=O)C1C(O)CCC2C1CC1N(C2)CCc2c1[nH]c1c2c(OC)ccc1' "altenuene": 'COc1cc(O)c2c(c1)C1=CC(O)C(CC1(OC2=O)C)O' "alternariol": 'Oc1cc(C)c2c(c1)oc(=O)c1c2cc(O)cc1O' "alumina": 'O=[Al]O[Al]=O' "aluminate": '[Al+3].[OH-].[OH-].[OH-].[OH-]' "amantadine": 'NC12CC3CC(C2)CC(C1)C3' "ambrisentan": 'COC(C(C(=O)O)Oc1nc(C)cc(n1)C)(c1ccccc1)c1ccccc1' "amidinomycin": 'NC1CCC(C1)C(=O)NCCC(=N)N' "amifostine": 'NCCCNCCSP(=O)(O)O' "amikacin": 'NCCC(C(=O)NC1CC(N)C(C(C1OC1OC(CO)C(C(C1O)N)O)O)OC1OC(CN)C(C(C1O)O)O)O' "amiloride": 'NC(=NC(=O)c1nc(Cl)c(nc1N)N)N' "aminophylline": 'Cn1c(=O)n(C)c2c(c1=O)[nH]cn2.Cn1c(=O)n(C)c2c(c1=O)[nH]cn2.NCCN' "aminopyrin": 'CN(c1c(C)n(n(c1=O)c1ccccc1)C)C' "amiodarone": 'CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCN(CC)CC)cccc2' "amisulpride": 'CCN1CCCC1CNC(=O)c1cc(c(cc1OC)N)S(=O)(=O)CC' "amitraz": 'CN(C=Nc1ccc(cc1C)C)C=Nc1ccc(cc1C)C' "amitriptyline": 'CN(CCC=C1c2ccccc2CCc2c1cccc2)C' "amlodipine": 'NCCOCC1=C(C(=O)OCC)C(C(=C(N1)C)C(=O)OC)c1ccccc1Cl' "amodiaquine": 'CCN(Cc1cc(ccc1O)Nc1ccnc2c1ccc(c2)Cl)CC' "amoxicillin": 'O=C(C(c1ccc(cc1)O)N)NC1C(=O)N2C1SC(C2C(=O)O)(C)C' "amphetamine": 'CC(Cc1ccccc1)N' "ampicillin": 'NC(c1ccccc1)C(=O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C' "amprenavir": 'CC(CN(S(=O)(=O)c1ccc(cc1)N)CC(C(Cc1ccccc1)NC(=O)OC1CCOC1)O)C' "anagliptin": 'N#CC1CCCN1C(=O)CNC(CNC(=O)c1cnc2n(c1)nc(c2)C)(C)C' "anandamide": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCO' "anastrozole": 'N#CC(c1cc(cc(c1)C(C#N)(C)C)Cn1ncnc1)(C)C' "anatase": 'O=[Ti]=O' "andalusol": 'C=CC(=C)CCC1C(C)(O)CC(C2C1(C)CCCC2(C)CO)O' "androstane": 'CC12CCCCC1CCC1C2CCC2(C1CCC2)C' "androstenedione": 'O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2=O)C)C' "androstenol": 'OC1CCC2(C(C1)CCC1C2CCC2(C1CC=C2)C)C' "anidulafungin": 'CCCCCOc1ccc(cc1)c1ccc(cc1)c1ccc(cc1)C(=O)NC1CC(O)C(O)NC(=O)C2C(O)C(CN2C(=O)C(NC(=O)C(NC(=O)C2N(C(=O)C(NC1=O)C(O)C)CC(C2)O)C(C(c1ccc(cc1)O)O)O)C(O)C)C' "anilino": '[NH]c1ccccc1' "anisamide": 'COc1ccccc1C(=O)N' "anisole": 'COc1ccccc1' "anisomycin": 'COc1ccc(cc1)CC1NCC(C1OC(=O)C)O' "anserine": 'NCCC(=O)NC(C(=O)O)Cc1cncn1C' "antheraxanthin": 'CC(=CC=CC=C(C=CC=C(C=CC12OC2(C)CC(CC1(C)C)O)C)C)C=CC=C(C=CC1=C(C)CC(CC1(C)C)O)C' "antipyrine": 'O=c1cc(n(n1c1ccccc1)C)C' "antofine": 'COc1ccc2c(c1)c1cc(OC)c(cc1c1c2CN2CCCC2C1)OC' "apetalactone": 'OCC12CCC(CC2C2(C(CC1)(C)C1CCC3(C(C1(CC2)C)CCC(=O)OC3C)C)C)(C)C' "apigenin": 'Oc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2O)O' "apixaban": 'COc1ccc(cc1)n1nc(c2c1C(=O)N(CC2)c1ccc(cc1)N1CCCCC1=O)C(=O)N' "apocynin": 'COc1cc(ccc1O)C(=O)C' "apomorphine": 'CN1CCc2c3C1Cc1ccc(c(c1-c3ccc2)O)O' "arabinose": 'OC1COC(C(C1O)O)O' "arabinotriose": 'OCC1OC(C(C1O)O)OCC1OC(C(C1O)O)OCC1OC(C(C1O)O)O' "arbutin": 'OCC1OC(Oc2ccc(cc2)O)C(C(C1O)O)O' "arcapillin": 'COc1cc2oc(cc(=O)c2c(c1OC)O)c1cc(OC)c(cc1O)O' "arenol": 'CC(=CCc1c(O)c(Cc2c(=O)oc(c(c2O)C)C)c(c(c1C(=O)C)O)O)C' "arginine": 'OC(=O)C(CCCN=C(N)N)N' "aripiprazole": 'O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl' "arjunetin": 'OCC1OC(OC(=O)C23CCC(C(C3C3=CCC4C(C3(CC2)C)(C)CCC2C4(C)CC(C(C2(C)C)O)O)O)(C)C)C(C(C1O)O)O' "aromadendrin": 'Oc1ccc(cc1)C1Oc2cc(O)cc(c2C(=O)C1O)O' "arsenobetaine": '[O-]C(=O)C[As+](C)(C)C' "artemether": 'COC1OC2OC3(C)CCC4C2(C(C1C)CCC4C)OO3' "arvelexin": 'N#CCc1c[nH]c2c1c(OC)ccc2' "aspartame": 'COC(=O)C(NC(=O)C(CC(=O)O)N)Cc1ccccc1' "aspartyl": 'O=[C]CC(=C=O)N' "aspergilliamide": 'ON=C(C(=O)NC(=O)CC(C)C)CC(C)C' "asperlicin": 'CC(CC1NC2N(C1=O)c1c(C2(O)CC2NC(=O)c3c(-n4c2nc2ccccc2c4=O)cccc3)cccc1)C' "aspirin": 'CC(=O)Oc1ccccc1C(=O)O' "astaxanthin": 'CC(=CC=CC=C(C=CC=C(C=CC1=C(C)C(=O)C(CC1(C)C)O)C)C)C=CC=C(C=CC1=C(C)C(=O)C(CC1(C)C)O)C' "atRA": 'CC(=CC=CC(=CC(=O)O)C)C=CC1=C(C)CCCC1(C)C' "atazanavir": 'COC(=O)NC(C(C)(C)C)C(=O)NN(Cc1ccc(cc1)c1ccccn1)CC(C(Cc1ccccc1)NC(=O)C(C(C)(C)C)NC(=O)OC)O' "atipamezole": 'CCC1(Cc2c(C1)cccc2)c1cnc[nH]1' "atomoxetine": 'CNCCC(c1ccccc1)Oc1ccccc1C' "atorvastatin": 'OC(CC(CC(=O)O)O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1' "atranorin": 'COC(=O)c1c(C)cc(c(c1O)C)OC(=O)c1c(C)cc(c(c1O)C=O)O' "atrazine": 'CCNc1nc(NC(C)C)nc(n1)Cl' "atropine": 'OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)N2C' "au": '[Au]' "auraptene": 'CC(=CCOc1ccc2c(c1)oc(=O)cc2)CCC=C(C)C' "avarol": 'Oc1ccc(c(c1)CC1(C)C(C)CCC2(C1CCC=C2C)C)O' "avibactam": 'NC(=O)C1CCC2CN1C(=O)N2OS(=O)(=O)O' "avobenzone": 'COc1ccc(cc1)C(=O)CC(=O)c1ccc(cc1)C(C)(C)C' "axitinib": 'CNC(=O)c1ccccc1Sc1ccc2c(c1)[nH]nc2C=Cc1ccccn1' "azathioprine": 'Cn1cnc(c1Sc1ncnc2c1[nH]cn2)[N+](=O)[O-]' "azilsartan": 'CCOc1nc2c(n1Cc1ccc(cc1)c1ccccc1c1[nH]oc(=O)n1)c(ccc2)C(=O)O' "azinphos-methyl": 'COP(=S)(SCn1nnc2c(c1=O)cccc2)OC' "azithromycin": 'CCC1OC(=O)C(C)C(OC2OC(C)C(C(C2)(C)OC)O)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(CC(CN(C(C(C1(C)O)O)C)C)C)(C)O' "azoxystrobin": 'COC=C(c1ccccc1Oc1ncnc(c1)Oc1ccccc1C#N)C(=O)OC' "baclofen": 'NCC(c1ccc(cc1)Cl)CC(=O)O' "bacteriopheophytin": 'COC(=O)C1C2=C3N=C(C(C3CCC(=O)OCC=C(CCCC(CCCC(CCCC(C)C)C)C)C)C)C=c3[nH]c(=CC4=NC(=Cc5[nH]c2c(C1=O)c5C)C(CC)C4C)c(c3C)C(=O)C' "baicalein": 'Oc1cc2oc(cc(=O)c2c(c1O)O)c1ccccc1' "baicalin": 'OC(=O)C1OC(Oc2cc3oc(cc(=O)c3c(c2O)O)c2ccccc2)C(C(C1O)O)O' "bambuterol": 'O=C(N(C)C)Oc1cc(cc(c1)OC(=O)N(C)C)C(CNC(C)(C)C)O' "batimastat": 'CNC(=O)C(NC(=O)C(C(C(=O)NO)CSc1cccs1)CC(C)C)Cc1ccccc1' "bazedoxifene": 'Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCCC1)c1ccc(cc1)O' "bda": 'CC(=O)/C=C/c1ccccc1' "bdpp": 'CC(P(c1ccccc1)c1ccccc1)CC(P(c1ccccc1)c1ccccc1)C' "beclomethasone": 'OCC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)Cl' "bellericoside": 'OCC1OC(OC(=O)C23CCC(CC3C3=CCC4C(C3(CC2)C)(C)CCC2C4(C)CC(C(C2(CO)CO)O)O)(C)C)C(C(C1O)O)O' "benomyl": 'CCCCNC(=O)n1c(NC(=O)OC)nc2c1cccc2' "benzbromarone": 'CCc1oc2c(c1C(=O)c1cc(Br)c(c(c1)Br)O)cccc2' "benzo-15-crown": 'O1CCOCCOc2c(OCCOCC1)cccc2' "benzocamalexin": 'c1ccc2c(c1)C(=C1Nc3c(S1)cccc3)C=N2' "benzofuroxan": '[O-][n+]1onc2c1cccc2' "benzophenone-3": 'COc1ccc(c(c1)O)C(=O)c1ccccc1' "benzphetamine": 'CN(C(Cc1ccccc1)C)Cc1ccccc1' "benztropine": 'CN1C2CCC1CC(C2)OC(c1ccccc1)c1ccccc1' "benzydamine": 'CN(CCCOc1nn(c2c1cccc2)Cc1ccccc1)C' "berberine": 'COc1c(OC)ccc2c1c[n+]1CCc3c(-c1c2)cc1c(c3)OCO1' "bergenin": 'OCC1OC2C(C(C1O)O)OC(=O)c1c2c(O)c(c(c1)O)OC' "bestatin": 'OC(C(=O)NC(C(=O)O)CC(C)C)C(Cc1ccccc1)N' "beta-lactam": 'C1CNC1=O' "betamethasone": 'OCC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)F' "betulin": 'OCC12CCC(C2C2C(CC1)(C)C1(C)CCC3C(C1CC2)(C)CCC(C3(C)C)O)C(=C)C' "beyerane": 'CC12CCC3C(C2)(CC1)CCC1C3(C)CCCC1(C)C' "bezafibrate": 'Clc1ccc(cc1)C(=O)NCCc1ccc(cc1)OC(C(=O)O)(C)C' "bgugaine": 'CCCCCCCCCCCCCCC1CCCN1C' "bicalutamide": 'N#Cc1ccc(cc1C(F)(F)F)NC(=O)C(CS(=O)(=O)c1ccc(cc1)F)(O)C' "bicuculline": 'CN1CCc2c(C1C1OC(=O)c3c1ccc1c3OCO1)cc1c(c2)OCO1' "biguanide": 'NC(=NC(=N)N)N' "bilirubin": 'C=CC1=C(C)C(=Cc2[nH]c(c(c2C)CCC(=O)O)Cc2[nH]c(c(c2CCC(=O)O)C)C=C2NC(=O)C(=C2C=C)C)NC1=O' "binap": 'c1ccc(cc1)P(c1ccc2c(c1c1c(ccc3c1cccc3)P(c1ccccc1)c1ccccc1)cccc2)c1ccccc1' "biotin": 'OC(=O)CCCCC1SCC2C1NC(=O)N2' "bisoprolol": 'OC(COc1ccc(cc1)COCCOC(C)C)CNC(C)C' "bisphenol": 'CC(c1ccc(cc1)O)(c1ccc(cc1)O)C' "bisphenol-A": 'CC(c1ccc(cc1)O)(c1ccc(cc1)O)C' "bn": 'CC(C(N)C)N' "boceprevir": 'O=C(NC(C)(C)C)NC(C(C)(C)C)C(=O)N1CC2C(C1C(=O)NC(C(=O)C(=O)N)CC1CCC1)C2(C)C' "boehmite": 'O[Al]=O' "boldine": 'COc1cc2-c3c(OC)c(O)cc4c3C(Cc2cc1O)N(C)CC4' "borrerine": 'CC(=CC1N(C)CCc2c1[nH]c1c2cccc1)C' "bortezomib": 'CC(CC(B(O)O)NC(=O)C(NC(=O)c1cnccn1)Cc1ccccc1)C' "boscalid": 'Clc1ccc(cc1)c1ccccc1NC(=O)c1cccnc1Cl' "bosentan": 'OCCOc1nc(nc(c1Oc1ccccc1OC)NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c1ncccn1' "bosutinib": 'COc1cc2c(cc1OCCCN1CCN(CC1)C)ncc(c2Nc1cc(OC)c(cc1Cl)Cl)C#N' "bpdo": '[O-][n+]1ccccc1c1cccc[n+]1[O-]' "bpy": 'c1ccc(nc1)c1ccccn1' "bradykinin": 'OCC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)O)CCCN=C(N)N)Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C1CCCN1C(=O)C1CCCN1C(=O)C(CCCN=C(N)N)N' "brartemicin": 'Oc1cc(C)c(c(c1)O)C(=O)OCC1OC(OC2OC(COC(=O)c3c(C)cc(cc3O)O)C(C(C2O)O)O)C(C(C1O)O)O' "brimonidine": 'Brc1c(ccc2c1nccn2)NC1=NCCN1' "bromadiolone": 'Brc1ccc(cc1)c1ccc(cc1)C(CC(c1c(=O)oc2c(c1O)cccc2)c1ccccc1)O' "bromine": 'BrBr' "bromocriptine": 'CC(CC1C(=O)N2CCCC2C2(N1C(=O)C(O2)(NC(=O)C1CN(C)C2C(=C1)c1cccc3c1c(C2)c([nH]3)Br)C(C)C)O)C' "bromodeoxyuridine": 'OCC1OC(CC1O)n1cc(Br)c(=O)[nH]c1=O' "bromperidol": 'Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Br' "bromsulphthalein": 'Brc1c(Br)c(Br)c2c(c1Br)C(=O)OC2(c1ccc(c(c1)S(=O)(=O)[O-])O)c1ccc(c(c1)S(=O)(=O)[O-])O.[Na+].[Na+]' "brucine": 'COc1cc2c(cc1OC)N1C3C42CCN2C4CC4C3C(CC1=O)OCC=C4C2' "budesonide": 'CCCC1OC2C(O1)(C(=O)CO)C1(C(C2)C2CCC3=CC(=O)C=CC3(C2C(C1)O)C)C' "bufadienolide": 'O=c1ccc(co1)C1CCC2C1(C)CCC1C2CCC2C1(C)CCCC2' "bufotenine": 'CN(CCc1c[nH]c2c1cc(O)cc2)C' "bupropion": 'Clc1cccc(c1)C(=O)C(NC(C)(C)C)C' "buspirone": 'O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1' "busulfan": 'CS(=O)(=O)OCCCCOS(=O)(=O)C' "butane": 'CCCC' "butanol": 'CCCCO' "butein": 'Oc1ccc(c(c1)O)C(=O)C=Cc1ccc(c(c1)O)O' "bztz": 'c1ccc2c(c1)scn2' "c-hexane": 'C1CCCCC1' "c-AMP": 'OC1C2OP(=O)(O)OCC2OC1n1c(Cl)nc2c1ncnc2N' "c-di-GMP": 'OC1C2OP(=O)(O)OCC3OC(C(C3OP(=O)(OCC2OC1n1cnc2c1[nH]c(N)nc2=O)O)O)n1cnc2c1[nH]c(N)nc2=O' "c60": 'c12c3c4c5c2c2c6c7c1c1c8c3c3c9c4c4c%10c5c5c2c2c6c6c%11c7c1c1c7c8c3c3c8c9c4c4c9c%10c5c5c2c2c6c6c%11c1c1c7c3c3c8c4c4c9c5c2c2c6c1c3c42' "cAAC": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)OCCOC(=O)CCCc1ccc(cc1)N(CCCl)CCCl' "cAMP": 'OC1C2OP(=O)(O)OCC2OC1n1cnc2c1ncnc2N' "cGMP": 'OC1C2OP(=O)(O)OCC2OC1n1cnc2c1[nH]c(N)nc2=O' "cabazitaxel": 'COC1C(=O)C2(C)C(OC)CC3C(C2C(C2(C(C1=C(C)C(OC(=O)C(C(c1ccccc1)NC(=O)OC(C)(C)C)O)C2)(C)C)O)OC(=O)c1ccccc1)(CO3)OC(=O)C' "cadaverine": 'NCCCCCN' "caffeate": 'OC(=O)C=Cc1ccc(c(c1)O)O' "caffeine": 'Cn1cnc2c1c(=O)n(C)c(=O)n2C' "calcein": 'OC(=O)CN(Cc1cc2c(cc1O)Oc1c(C32OC(=O)c2c3cccc2)cc(c(c1)O)CN(CC(=O)O)CC(=O)O)CC(=O)O' "calcein-AM": 'O=C(CN(Cc1c(ccc2c1Oc1c(CN(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)c(ccc1C12OC(=O)c2c1cccc2)OC(=O)C)OC(=O)C)CC(=O)OCOC(=O)C)OCOC(=O)C' "calcite": '[O-]C(=O)[O-].[Ca+2]' "calcitriol": 'OC1CC(O)C(=C)C(=CC=C2CCCC3(C2CCC3C(CCCC(O)(C)C)C)C)C1' "calpeptin": 'CCCCC(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)C=O' "calycanthoside": 'OCC1OC(Oc2c(OC)cc3c(c2OC)oc(=O)cc3)C(C(C1O)O)O' "calycopterin": 'COc1c(oc2c(c1=O)c(O)c(c(c2OC)OC)OC)c1ccc(cc1)O' "camalexin": 'c1csc(n1)c1c[nH]c2c1cccc2' "campesterol": 'OC1CCC2(C(=CCC3C2CCC2(C3CCC2C(CCC(C(C)C)C)C)C)C1)C' "camphene": 'C=C1C2CCC(C1(C)C)C2' "camphor": 'O=C1CC2C(C1(C)CC2)(C)C' "camptosar": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(cc4c(c3Cn1c2=O)CC)OC(=O)N1CCC(CC1)N1CCCCC1' "camptothecin": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O' "camptothecine": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O' "canagliflozin": 'OCC1OC(c2ccc(c(c2)Cc2ccc(s2)c2ccc(cc2)F)C)C(C(C1O)O)O' "candesartan": 'CCOc1nc2c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)c(ccc2)C(=O)O' "canertinib": 'C=CC(=O)Nc1cc2c(ncnc2cc1OCCCN1CCOCC1)Nc1ccc(c(c1)Cl)F' "cannabidiol": 'CCCCCc1cc(O)c(c(c1)O)C1C=C(C)CCC1C(=C)C' "cannabigerol": 'CCCCCc1cc(O)c(c(c1)O)CC=C(CCC=C(C)C)C' "cannabinol": 'CCCCCc1cc(O)c2-c3cc(C)ccc3C(Oc2c1)(C)C' "canophyllol": 'OCC12CCC(CC2C2(C(CC1)(C)C1CCC3(C(C1(CC2)C)CCC(=O)C3C)C)C)(C)C' "cantharidin": 'O=C1OC(=O)C2(C1(C)C1CCC2O1)C' "canthaxanthin": 'CC(=CC=CC=C(C=CC=C(C=CC1=C(C)C(=O)CCC1(C)C)C)C)C=CC=C(C=CC1=C(C)C(=O)CCC1(C)C)C' "capillarisin": 'COc1c(O)cc2c(c1O)c(=O)cc(o2)Oc1ccc(cc1)O' "caprolactam": 'O=C1CCCCCN1' "capsaicin": 'COc1cc(CNC(=O)CCCCC=CC(C)C)ccc1O' "capsazepine": 'Clc1ccc(cc1)CCNC(=S)N1CCCc2c(C1)cc(O)c(c2)O' "captafol": 'ClC(C(SN1C(=O)C2C(C1=O)CC=CC2)(Cl)Cl)Cl' "captan": 'ClC(SN1C(=O)C2C(C1=O)CC=CC2)(Cl)Cl' "captopril": 'SCC(C(=O)N1CCCC1C(=O)O)C' "caramiphen": 'CCN(CCOC(=O)C1(CCCC1)c1ccccc1)CC' "carbachol": 'NC(=O)OCC[N+](C)(C)C.[Cl-]' "carbamazepine": 'NC(=O)N1c2ccccc2C=Cc2c1cccc2' "carbaryl": 'CNC(=O)Oc1cccc2c1cccc2' "carbendazim": 'COC(=O)Nc1nc2c([nH]1)cccc2' "carbenicillin": 'O=C(C(c1ccccc1)C(=O)O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C' "carbobenzoxy-Leu-Leu-leucinal": 'O=CC(NC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C)CC(C)C' "carbofuran": 'CNC(=O)Oc1cccc2c1OC(C2)(C)C' "cardamonin": 'COc1cc(O)cc(c1C(=O)C=Cc1ccccc1)O' "cardiolipin": 'CCCCCCCCCCCCCCCCCC(=O)OC(COP(=O)(OCC(COP(=O)(OCC(OC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)O)O)O)COC(=O)CCCCCCCCCCCCCCCCC' "carnosine": 'NCCC(=O)NC(C(=O)O)Cc1[nH]cnc1' "carnosol": 'O=C1OC2CC3C1(CCCC3(C)C)c1c2cc(c(c1O)O)C(C)C' "carvacrol": 'CC(c1ccc(c(c1)O)C)C' "carvone": 'CC(=C)C1CC=C(C(=O)C1)C' "cassane": 'CCC1CCC2C(C1C)CCC1C2(C)CCCC1(C)C' "catalpol": 'OCC1OC(OC2OC=CC3C2C2(CO)OC2C3O)C(C(C1O)O)O' "catechin": 'Oc1cc2OC(c3ccc(c(c3)O)O)C(Cc2c(c1)O)O' "catechol": 'Oc1ccccc1O' "catecholamine": 'Oc1c(N)cccc1O' "cathinone": 'CC(C(=O)c1ccccc1)N' "cdt": 'C1C/C=C\CC/C=C\CC/C=C\1' "cefadroxil": 'O=C(C(c1ccc(cc1)O)N)NC1C(=O)N2C1SCC(=C2C(=O)O)C' "cefazolin": 'O=C(NC1C(=O)N2C1SCC(=C2C(=O)O)CSc1nnc(s1)C)Cn1cnnn1' "cefixime": 'Nc1nc(cs1)C(=NOCC(=O)O)C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)C=C' "ceftriaxone": 'CON=C(c1csc(n1)N)C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)CSc1nc(=O)c(=O)[nH]n1C' "celastrol": 'O=C1C=C2C(=CC=C3C2(C)CCC2(C3(C)CCC3(C2CC(C)(CC3)C(=O)O)C)C)C(=C1O)C' "celecoxib": 'Cc1ccc(cc1)c1cc(nn1c1ccc(cc1)S(=O)(=O)N)C(F)(F)F' "celocoxib": 'Cc1ccc(cc1)c1cc(nn1c1ccc(cc1)S(=O)(=O)N)C(F)(F)F' "cephalexin": 'NC(c1ccccc1)C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)C' "cepharanthine": 'COc1cc2CCN(C3c2cc1Oc1c2c(CCN(C2Cc2ccc(Oc4cc(C3)ccc4OC)cc2)C)cc2c1OCO2)C' "cetirizine": 'OC(=O)COCCN1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1' "chamazulene": 'CCc1ccc(c2-c(c1)c(C)cc2)C' "charcoal": '[C]' "cheirolin": 'S=C=NCCCS(=O)(=O)C' "chelerythrine": 'COc1c(OC)ccc2c1c[n+](C)c1c2ccc2c1cc1OCOc1c2' "chelidonine": 'CN1Cc2c(C3C1c1cc4OCOc4cc1CC3O)ccc1c2OCO1' "chenodeoxycholate": 'OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)O)C)C)O)C' "chexane": 'C1CCCCC1' "chl": 'COC(=O)C1C2=C3[NH+]=C(C(C3CCC(=O)OCC=C(CCCC(CCCC(CCCC(C)C)C)C)C)C)C=c3[n-]c(=CC4=[NH+]C(=Cc5[n-]c2c(C1=O)c5C)C(=C4C=O)CC)c(c3C)C=C.[Mg+2]' "chlorambucil": 'ClCCN(c1ccc(cc1)CCCC(=O)O)CCCl' "chloramphenicol": 'OCC(C(c1ccc(cc1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl' "chlordecone": 'O=C1C2(Cl)C3(C4(C1(Cl)C1(C2(C3(Cl)C(C41Cl)(Cl)Cl)Cl)Cl)Cl)Cl' "chlordiazepoxide": 'CN=C1CN(O)C(=c2c(=N1)ccc(c2)Cl)c1ccccc1' "chloroform": 'ClC(Cl)Cl' "chloroprene": 'C=CC(=C)Cl' "chloroquine": 'CCN(CCCC(Nc1ccnc2c1ccc(c2)Cl)C)CC' "chlorothalonil": 'N#Cc1c(Cl)c(C#N)c(c(c1Cl)Cl)Cl' "chlorpromazine": 'CN(CCCN1c2ccccc2Sc2c1cc(Cl)cc2)C' "chlorpyrifos": 'CCOP(=S)(Oc1nc(Cl)c(cc1Cl)Cl)OCC' "cholesterol": 'CC(CCCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O)C)C' "chorismate": 'OC1C=CC(=CC1OC(=C)C(=O)O)C(=O)O' "chrome": '[Cr]' "chromenone": 'O=c1ccc2c(o1)cccc2' "chromone": 'O=c1ccoc2c1cccc2' "chrysin": 'Oc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1' "chrysoeriol": 'COc1cc(ccc1O)c1cc(=O)c2c(o1)cc(cc2O)O' "chrysophanol": 'Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)ccc1' "chxn": 'NC1CCCCC1N' "ciclopirox": 'Cc1cc(C2CCCCC2)n(c(=O)c1)O' "cidofovir": 'OCC(Cn1ccc(nc1=O)N)OCP(=O)(O)O' "ciguatoxin": 'OCC(C=CC1C=CCC2C(O1)C(O)C1C(O2)CC2C(O1)C=CC1C(O2)C=CC2C(O1)CC=CCC1C(O2)CC(O)C2(C(O1)CC1C(O2)CC(C)CC2C(O1)CC1OC3C(C(C(C1O2)C)O)OC1(C(C3C)C)OCC(C1)O)C)O' "cilastatin": 'OC(=O)C(CSCCCCC=C(C(=O)O)NC(=O)C1CC1(C)C)N' "cilnidipine": 'COCCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCC=Cc1ccccc1)C' "cilostazol": 'O=C1CCc2c(N1)ccc(c2)OCCCCc1nnnn1C1CCCCC1' "cimetidine": 'N#CNC(=NC)NCCSCc1nc[nH]c1C' "cinnamaldehyde": 'O=CC=Cc1ccccc1' "cinnamolide": 'O=C1OCC2C1=CCC1C2(C)CCCC1(C)C' "cinnoline": 'c1ccc2c(c1)nncc2' "cinobufagin": 'OC1CCC2(C(C1)CCC1C2CCC2(C31OC3C(C2c1ccc(=O)oc1)OC(=O)C)C)C' "ciprofloxacin": 'Fc1cc2c(cc1N1CCNCC1)n(cc(c2=O)C(=O)O)C1CC1' "cirsilineol": 'COc1cc2oc(cc(=O)c2c(c1OC)O)c1ccc(c(c1)OC)O' "cirsimaritin": 'COc1cc2oc(cc(=O)c2c(c1OC)O)c1ccc(cc1)O' "cis-UCA": 'OC(=O)C=Cc1cnc[nH]1' "cis-hinokiresinol": 'C=CC(c1ccc(cc1)O)C=Cc1ccc(cc1)O' "cis-platin": 'Cl[Pt+2]Cl.N.N' "cis-violaxanthin": 'CC(=CC=CC=C(C=CC=C(C=CC12OC2(C)CC(CC1(C)C)O)C)C)C=CC=C(C=CC12OC2(C)CC(CC1(C)C)O)C' "citalopram": 'N#Cc1ccc2c(c1)COC2(CCCN(C)C)c1ccc(cc1)F' "citrinin": 'CC1OC=C2C(=C(C)C(=C(C2=O)C(=O)O)O)C1C' "citronellal": 'O=CCC(CCC=C(C)C)C' "citronellol": 'OCCC(CCC=C(C)C)C' "citrulline": 'NC(=O)NCCCC(C(=O)O)N' "clarithromycin": 'CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(C(O2)C)O)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(CC(C(=O)C(C(C1(C)O)O)C)C)(C)OC' "clavatol": 'CC(=O)c1cc(C)c(c(c1O)C)O' "clavulanate": 'OC(=O)C1N2C(OC1=CCO)CC2=O' "clemizole": 'Clc1ccc(cc1)Cn1c(CN2CCCC2)nc2c1cccc2' "clerosterol": 'CCC(C(=C)C)CCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O)C' "clinafloxacin": 'NC1CCN(C1)c1c(F)cc2c(c1Cl)n(cc(c2=O)C(=O)O)C1CC1' "clobazam": 'Clc1ccc2c(c1)N(C(=O)CC(=O)N2C)c1ccccc1' "clodronate": 'ClC(P(=O)(O)O)(P(=O)(O)O)Cl' "clofarabine": 'OCC1OC(C(C1O)F)n1cnc2c1nc(Cl)nc2N' "clofibrate": 'CCOC(=O)C(Oc1ccc(cc1)Cl)(C)C' "clofilium": 'CCCCCCC[N+](CCCCc1ccc(cc1)Cl)(CC)CC' "clomipramine": 'CN(CCCN1c2ccccc2CCc2c1cc(Cl)cc2)C' "clonazepam": 'O=C1CN=C(c2c(N1)ccc(c2)[N+](=O)[O-])c1ccccc1Cl' "clonidine": 'Clc1cccc(c1NC1=NCCN1)Cl' "clopidogrel": 'COC(=O)C(c1ccccc1Cl)N1CCc2c(C1)ccs2' "clothianidin": '[O-][N+](=O)NC(=NC)NCc1cnc(s1)Cl' "clotrimazole": 'Clc1ccccc1C(n1cncc1)(c1ccccc1)c1ccccc1' "clovanemagnolol": 'C=CCc1ccc(c(c1)c1cc(CC=C)ccc1O)OC1CC(C2C31CCC(C(C3)(C)CC2)O)(C)C' "cloxacillin": 'OC(=O)C1N2C(=O)C(C2SC1(C)C)NC(=O)c1c(C)onc1c1ccccc1Cl' "clozapine": 'CN1CCN(CC1)C1=c2ccccc2=Nc2c(N1)cc(Cl)cc2' "cnidilin": 'COc1c2occc2c(c2c1oc(=O)cc2)OCC=C(C)C' "coal": '[Al]#[Co]' "cobicistat": 'O=C(NC(Cc1ccccc1)CCC(Cc1ccccc1)NC(=O)C(NC(=O)N(Cc1csc(n1)C(C)C)C)CCN1CCOCC1)OCc1cncs1' "cocaine": 'COC(=O)C1C(CC2N(C1CC2)C)OC(=O)c1ccccc1' "cod": 'C1CC=CCCC=C1' "codeine": 'COc1ccc2c3c1OC1C43CCN(C(C2)C4C=CC1O)C' "coe": 'C1CCCC=CCC1' "coelenterazine": 'Oc1ccc(cc1)Cc1nc2-n(c1=O)cc([nH]c2Cc1ccccc1)c1ccc(cc1)O' "colchicine": 'COc1c(OC)cc2c(-c3ccc(c(=O)cc3C(CC2)NC(=O)C)OC)c1OC' "combretastatin-A4": 'COc1cc(C=Cc2ccc(c(c2)O)OC)cc(c1OC)OC' "confluentin": 'CC(=CCCC1(C)C=Cc2c(O1)cc(cc2O)C)CCC=C(C)C' "coniferaldehyde": 'O=CC=Cc1ccc(c(c1)OC)O' "coniferin": 'OCC=Cc1ccc(c(c1)OC)OC1OC(CO)C(C(C1O)O)O' "coptisine": 'C1Oc2c(O1)cc1-c3cc4ccc5c(c4c[n+]3CCc1c2)OCO5' "corannulene": 'c1cc2ccc3c4c2c2c1ccc1c2c4c(cc1)cc3' "cordycepin": 'OCC1CC(C(O1)n1cnc2c1ncnc2N)O' "corilagin": 'OC1C2COC(=O)c3cc(O)c(c(c3-c3c(C(=O)OC1C(C(O2)OC(=O)c1cc(O)c(c(c1)O)O)O)cc(O)c(c3O)O)O)O' "coronene": 'c1cc2ccc3c4c2c2c1ccc1c2c2c4c(cc3)ccc2cc1' "corticosterone": 'OCC(=O)C1CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C' "cortisol": 'OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C' "cortisone": 'OCC(=O)C1(O)CCC2C1(C)CC(=O)C1C2CCC2=CC(=O)CCC12C' "corydalmine": 'COc1cc2c(cc1OC)CCN1C2Cc2ccc(c(c2C1)OC)O' "corynoxidine": 'COc1cc2CC[N+]3(C(c2cc1OC)Cc1c(C3)c(OC)c(cc1)OC)[O-]' "cot": 'C1=CC=CC=CC=C1' "cotinine": 'O=C1CCC(N1C)c1cccnc1' "coumarin": 'O=c1ccc2c(o1)cccc2' "coumarin-6": 'CCN(c1ccc2c(c1)oc(=O)c(c2)c1nc2c(s1)cccc2)CC' "coumestan": 'O=c1oc2ccccc2c2c1c1ccccc1o2' "coumestrol": 'Oc1ccc2c(c1)oc(=O)c1c2oc2c1ccc(c2)O' "cptn": 'NC1CCCC1N' "creatine": 'OC(=O)CN(C(=N)N)C' "creatinine": 'O=C1N=C(N(C1)C)N' "creosol": 'COc1cc(C)ccc1O' "crizotinib": 'Nc1ncc(cc1OC(c1c(Cl)ccc(c1Cl)F)C)c1cnn(c1)C1CCNCC1' "crocin": 'OCC1OC(OCC2OC(OC(=O)C(=CC=CC(=CC=CC=C(C=CC=C(C(=O)OC3OC(COC4OC(CO)C(C(C4O)O)O)C(C(C3O)O)O)C)C)C)C)C(C(C2O)O)O)C(C(C1O)O)O' "cromolyn": 'OC(COc1cccc2c1c(=O)cc(o2)C(=O)O)COc1cccc2c1c(=O)cc(o2)C(=O)O' "crotonaldehyde": 'CC=CC=O' "crypt-211": 'C1COCCN2CCOCCN(CCO1)CCOCC2' "crypt-222": 'C1COCCN2CCOCCOCCN(CCO1)CCOCCOCC2' "cryptocapsin": 'CC(=CC=CC=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C)C=CC=C(C=CC(=O)C1(C)CC(CC1(C)C)O)C' "curcumin": 'COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(c(c2)OC)O)ccc1O' "cyanidin": 'Oc1cc(O)c2c(c1)[o+]c(c(c2)O)c1ccc(c(c1)O)O' "cyanidine": 'n1cncnc1' "cyanurate": 'O=c1[nH]c(=O)[nH]c(=O)[nH]1' "cyclam": 'C1CNCCNCCCNCCNC1' "cyclen": 'N1CCNCCNCCNCC1' "cyclic-AMP": 'OC1C2OP(=O)([O-])OCC2OC1n1cnc2c1ncnc2N' "cycloartane": 'CC(CCCC(C1CCC2(C1(C)CCC13C2CCC2C3(C1)CCCC2(C)C)C)C)C' "cyclobutane": 'C1CCC1' "cyclohexane": 'C1CCCCC1' "cycloheximide": 'CC1CC(C)C(=O)C(C1)C(CC1CC(=O)NC(=O)C1)O' "cyclonerodiol": 'CC(=CCCC(C1CCC(C1C)(C)O)(O)C)C' "cyclophosphamide": 'ClCCN(P1(=O)NCCCO1)CCCl' "cyclopropane": 'C1CC1' "cyclosarin": 'CP(=O)(OC1CCCCC1)F' "cyclotriphosphazene": 'p1npnpn1' "cyfluthrin": 'N#CC(c1ccc(c(c1)Oc1ccccc1)F)OC(=O)C1C(C1(C)C)C=C(Cl)Cl' "cynaropicrin": 'OCC(=C)C(=O)OC1CC(=C)C2C(C3C1C(=C)C(=O)O3)C(=C)C(C2)O' "cypermethrin": 'N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)C=C(Cl)Cl' "cyproconazole": 'CC(C(c1ccc(cc1)Cl)(Cn1ncnc1)O)C1CC1' "cyprodinil": 'Cc1nc(Nc2ccccc2)nc(c1)C1CC1' "cyromazine": 'Nc1nc(NC2CC2)nc(n1)N' "cyrtominetin": 'Oc1ccc(cc1O)C1CC(=O)c2c(O1)c(C)c(c(c2O)C)O' "cystamine": 'NCCSSCCN' "cysteamine": 'NCCS' "cysteinyl": 'NC([C]=O)CS' "cyt": 'Nc1cc[nH]c(=O)n1' "cytarabine": 'OCC1OC(C(C1O)O)n1ccc(nc1=O)N' "cytidine": 'OCC1OC(C(C1O)O)n1ccc(nc1=O)N' "cytisine": 'O=c1cccc2n1CC1CNCC2C1' "cytosine": 'Nc1ccnc(=O)[nH]1' "d-GalN": 'OCC1OC(O)C(C(C1O)O)N' "d-MPH": 'COC(=O)C(c1ccccc1)C1CCCCN1' "d-amphetamine": 'CC(Cc1ccccc1)N' "d-arginine": 'OC(=O)C(CCCN=C(N)N)N' "d-cycloserine": 'NC1CONC1=O' "d-galactosamine": 'OCC1OC(O)C(C(C1O)O)N' "d-galactose": 'OCC1OC(O)C(C(C1O)O)O' "d-glucose": 'OCC1OC(O)C(C(C1O)O)O' "d-mannitol": 'OCC(C(C(C(CO)O)O)O)O' "d-methamphetamine": 'CNC(Cc1ccccc1)C' "d-ribofuranose": 'OCC1OC(C(C1O)O)O' "d-serine": 'OCC(C(=O)O)N' "d-tubocurarine": 'COc1cc2CCN(C3c2cc1Oc1cc(ccc1O)CC1c2c(CC[N+]1(C)C)cc(c(c2Oc1ccc(C3)cc1)O)OC)C' "d-tyrosine": 'OC(=O)C(Cc1ccc(cc1)O)N' "d4T": 'Cc1cn(C2OC(C=C2)CO)c(=O)[nH]c1=O' "d4T-6PEG-TIBO": 'OCC1C=CC(O1)n1cc(CCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOc2ccc3c4c2CN(CC=C(C)C)C(Cn4c(=S)[nH]3)C)c(=O)[nH]c1=O' "d5": 'C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](O1)(C)C)(C)C' "dAMP": 'OC1CC(OC1COP(=O)(O)O)n1cnc2c1ncnc2N' "dATP": 'OC1CC(OC1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1cnc2c1ncnc2N' "dCDP": 'OC1CC(OC1COP(=O)(OP(=O)(O)O)O)n1ccc(nc1=O)N' "dCMP": 'OC1CC(OC1COP(=O)(O)O)n1ccc(nc1=O)N' "dCTP": 'OC1CC(OC1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1ccc(nc1=O)N' "dFdU": 'OCC1OC(C(C1O)(F)F)n1ccc(=O)[nH]c1=O' "dGTP": 'OC1CC(OC1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1cnc2c1[nH]c(N)nc2=O' "dNTP": 'CCOP(=S)(Oc1ccc(cc1)[N+](=O)[O-])OCC' "dTMP": 'OC1CC(OC1COP(=O)(O)O)n1cc(C)c(=O)[nH]c1=O' "dTTP": 'OC1CC(OC1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1cc(C)c(=O)[nH]c1=O' "dUTP": 'OC1CC(OC1COP(=O)(OP(=O)(OP(=O)(O)O)O)O)n1ccc(=O)[nH]c1=O' "dabigatran": 'OC(=O)CCN(C(=O)c1ccc2c(c1)nc(n2C)CNc1ccc(cc1)C(=N)N)c1ccccn1' "dabrafenib": 'Nc1nccc(n1)c1sc(nc1c1cccc(c1F)NS(=O)(=O)c1c(F)cccc1F)C(C)(C)C' "dach": 'NC1CCCCC1N' "dacomitinib": 'COc1cc2ncnc(c2cc1NC(=O)C=CCN1CCCCC1)Nc1ccc(c(c1)Cl)F' "daidzein": 'Oc1ccc(cc1)c1coc2c(c1=O)ccc(c2)O' "daidzin": 'OCC1OC(Oc2ccc3c(c2)occ(c3=O)c2ccc(cc2)O)C(C(C1O)O)O' "dammarane": 'CC(CCCC(C1CCC2(C1CCC1C2(C)CCC2C1(C)CCCC2(C)C)C)C)C' "danofloxacin": 'CN1CC2CC1CN2c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)O' "dansylhydrazine": 'NNS(=O)(=O)c1cccc2c1cccc2N(C)C' "dantrolene": 'O=C1CN(C(=O)N1)N=Cc1ccc(o1)c1ccc(cc1)[N+](=O)[O-]' "danusertib": 'COC(C(=O)N1Cc2c(C1)[nH]nc2NC(=O)c1ccc(cc1)N1CCN(CC1)C)c1ccccc1' "daphnetin": 'O=c1ccc2c(o1)c(O)c(cc2)O' "dapsone": 'Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)N' "darapladib": 'CCN(CCN(C(=O)Cn1c(SCc2ccc(cc2)F)nc(=O)c2c1CCC2)Cc1ccc(cc1)c1ccc(cc1)C(F)(F)F)CC' "darexaban": 'COc1ccc(cc1)C(=O)Nc1cccc(c1NC(=O)c1ccc(cc1)N1CCCN(CC1)C)O' "darunavir": 'CC(CN(S(=O)(=O)c1ccc(cc1)N)CC(C(Cc1ccccc1)NC(=O)OC1COC2C1CCO2)O)C' "dasatinib": 'OCCN1CCN(CC1)c1cc(nc(n1)C)Nc1ncc(s1)C(=O)Nc1c(C)cccc1Cl' "daunomycin": 'COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)C(OC1CC(N)C(C(O1)C)O)CC(C2)(O)C(=O)C' "daunorubicin": 'COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)C(OC1CC(N)C(C(O1)C)O)CC(C2)(O)C(=O)C' "dba": 'O=C(/C=C/c1ccccc1)/C=C/c1ccccc1' "dbpp": 'C(Cc1cccc2c1c1ccccc1[pH]2)Cc1cccc2c1c1ccccc1[pH]2' "ddI": 'OCC1CCC(O1)n1cnc2c1[nH]cnc2=O' "deacetylsclerotiorin": 'CCC(C=C(C=CC1=CC2=C(Cl)C(=O)C(C(=O)C2=CO1)(C)O)C)C' "decursin": 'O=C(C=C(C)C)OC1Cc2cc3ccc(=O)oc3cc2OC1(C)C' "deferoxamine": 'NCCCCCN(C(=O)CCC(=O)NCCCCCN(C(=O)CCC(=O)NCCCCCN(C(=O)C)O)O)O' "dehydroepiandrosterone": 'OC1CCC2(C(=CCC3C2CCC2(C3CCC2=O)C)C1)C' "delavirdine": 'CC(Nc1cccnc1N1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)NS(=O)(=O)C)C' "deoxycytidine": 'OCC1OC(CC1O)n1ccc(nc1=O)N' "deoxynivalenol": 'OCC12C(C=C(C(=O)C1O)C)OC1C3(C2(C)CC1O)CO3' "deoxyuridine": 'OCC1OC(CC1O)n1ccc(=O)[nH]c1=O' "depe": 'CCP(CCP(CC)CC)CC' "desaspidinol": 'CCCC(=O)c1c(O)cc(cc1O)OC' "desferrioxamine": 'NCCCCCN(C(=O)CCC(=O)NCCCCCN(C(=O)CCC(=O)NCCCCCN(C(=O)C)O)O)O' "desipramine": 'CNCCCN1c2ccccc2CCc2c1cccc2' "desloratadine": 'Clc1ccc2c(c1)CCc1c(C2=C2CCNCC2)nccc1' "desmosterol": 'OC1CCC2(C(=CCC3C2CCC2(C3CCC2C(CCC=C(C)C)C)C)C1)C' "desogestrel": 'CCC12CC(=C)C3C(C1CCC2(O)C#C)CCC1=CCCCC31' "devazepide": 'O=C(c1cc2c([nH]1)cccc2)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2' "dexametasone": 'OCC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)F' "dexamethasone": 'OCC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)F' "dexamethazone": 'OCC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)F' "dexmedetomidine": 'Cc1cccc(c1C)C(c1cnc[nH]1)C' "dexmethylphenidate": 'COC(=O)C(c1ccccc1)C1CCCCN1' "dextrorphan": 'Oc1ccc2c(c1)C13CCCCC3C(C2)N(CC1)C' "dialanine": 'CC(C(=O)O)NC(=O)C(N)C' "diars": 'C[As](c1ccccc1[As](C)C)C' "diasesartemin": 'COc1cc(cc(c1OC)OC)C1OCC2C1COC2c1cc(OC)c2c(c1)OCO2' "diazepam": 'Clc1ccc2c(c1)C(=NCC(=O)N2C)c1ccccc1' "diazepine": 'C1=CC=CC=NN1' "diazinon": 'CCOP(=S)(Oc1cc(C)nc(n1)C(C)C)OCC' "diazoxon": 'CCOP(=O)(Oc1cc(C)nc(n1)C(C)C)OCC' "dichlorvos": 'COP(=O)(OC=C(Cl)Cl)OC' "diclofenac": 'OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl' "dicloxacillin": 'OC(=O)C1N2C(=O)C(C2SC1(C)C)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl' "dien": 'NCCNCCN' "dienogest": 'N#CCC1(O)CCC2C1(C)CCC1=C3CCC(=O)C=C3CCC21' "difenacoum": 'O=c1oc2ccccc2c(c1C1CC(Cc2c1cccc2)c1ccc(cc1)c1ccccc1)O' "difenoconazole": 'CC1COC(O1)(Cn1cncn1)c1ccc(cc1Cl)Oc1ccc(cc1)Cl' "diflunisal": 'Fc1ccc(c(c1)F)c1ccc(c(c1)C(=O)O)O' "digitoxin": 'O=C1OCC(=C1)C1CCC2(C1(C)CCC1C2CCC2C1(C)CCC(C2)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)O)O' "digoxin": 'O=C1OCC(=C1)C1CCC2(C1(C)C(O)CC1C2CCC2C1(C)CCC(C2)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)O)O' "dihexa": 'CCCCCC(=O)NC(C(=O)NC(C(=O)NCCCCCC(=O)N)C(CC)C)Cc1ccc(cc1)O' "diltiazem": 'COc1ccc(cc1)C1Sc2ccccc2N(C(=O)C1OC(=O)C)CCN(C)C' "dimedone": 'O=C1CC(=O)CC(C1)(C)C' "dimethoate": 'CNC(=O)CSP(=S)(OC)OC' "dimethylformamide": 'O=CN(C)C' "dimsyl": '[CH2]S(=O)C' "dimyristoylphosphatidylglycerol": 'CCCCCCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCCCCCCC)COP(=O)(OCC(CO)O)O' "dinotefuran": 'CN=C(N[N+](=O)[O-])NCC1COCC1' "dioleoylphosphatidylcholine": 'CCCCCCCCC=CCCCCCCCC(=O)OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(OCC[N+](C)(C)C)[O-]' "diop": 'CC1(C)OC(C(O1)CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1' "dioscin": 'OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C3(O4)CCC(CO3)C)C)C2)C)C(C(C1OC1OC(C)C(C(C1O)O)O)O)OC1OC(C)C(C(C1O)O)O' "diosmetin": 'COc1ccc(cc1O)c1cc(=O)c2c(o1)cc(cc2O)O' "diosmin": 'COc1ccc(cc1O)c1cc(=O)c2c(o1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "diospyrin": 'Cc1cc(O)c2c(c1)C(=O)C(=CC2=O)c1c(C)cc2c(c1O)C(=O)C=CC2=O' "dipamp": 'COc1ccccc1P(c1ccccc1)CCP(c1ccccc1OC)c1ccccc1' "diphenhydramine": 'CN(CCOC(c1ccccc1)c1ccccc1)C' "diphenyleneiodonium": 'c1ccc2-c3c([I+]c2c1)cccc3' "diphos": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1' "diphos (dppe)": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1' "diphos dppe": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1' "dipicrylamine": '[O-][N+](=O)c1cc(cc(c1Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]' "dippe": 'CC(P(C(C)C)CCP(C(C)C)C(C)C)C' "dipyridamole": 'OCCN(c1nc(N2CCCCC2)c2c(n1)c(nc(n2)N(CCO)CCO)N1CCCCC1)CCO' "discodermolide": 'C=CC=CC(C(C(C(C(CC(=CC(C(C(C=CC(CC1OC(=O)C(C(C1C)O)C)O)C)O)C)C)C)O)C)OC(=O)N)C' "dityrosine": 'NC(C(=O)O)Cc1ccc(c(c1)c1cc(CC(C(=O)O)N)ccc1O)O' "diuron": 'O=C(N(C)C)Nc1ccc(c(c1)Cl)Cl' "dizocilpine": 'CC12NC(c3c2cccc3)Cc2c1cccc2' "dma": 'CC(=O)N(C)C' "dmbp": 'Cc1cccc(n1)c1cccc(n1)C' "dmgH": 'O/N=C(/C(=N/O)/C)\C' "dmpe": 'CC(P(C)C)P(C)C' "dmpm": 'CP(CP(C)C)C' "dobutamine": 'CC(CCc1ccc(cc1)O)NCCc1ccc(c(c1)O)O' "docetaxel": 'CC(=O)OC12COC1CC(C1(C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(C(c3ccccc3)NC(=O)OC(C)(C)C)O)C(=C(C2(C)C)C(C1=O)O)C)C)O' "dolutegravir": 'Fc1ccc(c(c1)F)CNC(=O)c1cn2CC3OCCC(N3C(=O)c2c(c1=O)O)C' "donepezil": 'COc1cc2c(cc1OC)CC(C2=O)CC1CCN(CC1)Cc1ccccc1' "dopamine": 'NCCc1ccc(c(c1)O)O' "dorsomorphin": 'C1CCN(CC1)CCOc1ccc(cc1)c1cnc2n(c1)ncc2c1ccncc1' "dorzolamide": 'CCNC1CC(C)S(=O)(=O)c2c1cc(s2)S(=O)(=O)N' "doxazolidine": 'OCC(=O)C1(O)CC(OC2CC3NCOC3C(O2)C)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC' "doxorubicin": 'OCC(=O)C1(O)CC(OC2CC(N)C(C(O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC' "doxycycline": 'CN(C1C(=O)C(=C(C2(C1C(O)C1C(C)c3cccc(c3C(=C1C2=O)O)O)O)O)C(=O)N)C' "doxylamine": 'CN(CCOC(c1ccccn1)(c1ccccc1)C)C' "dppb": 'C(CP(c1ccccc1)c1ccccc1)CCP(c1ccccc1)c1ccccc1' "dppe": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1' "dppe (diphos)": 'c1ccc(cc1)P(c1ccccc1)CCP(c1ccccc1)c1ccccc1' "dppeO": 'CCP(=O)(c1ccccc1)c1ccccc1' "dppf": 'c1cc[c-](c1)P(c1ccccc1)c1ccccc1.c1cc[c-](c1)P(c1ccccc1)c1ccccc1.[Fe+2]' "dppm": 'c1ccc(cc1)P(c1ccccc1)CP(c1ccccc1)c1ccccc1' "dppmO": 'CP(=O)(c1ccccc1)c1ccccc1' "dppp": 'C(CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1' "dpppO": 'CCCP(=O)(c1ccccc1)c1ccccc1' "dppv": 'c1ccc(cc1)P(c1ccccc1)C=CP(c1ccccc1)c1ccccc1' "dppz": 'c1cnc2c(c1)c1nc3ccccc3nc1c1c2nccc1' "dronedarone": 'CCCCc1oc2c(c1C(=O)c1ccc(cc1)OCCCN(CCCC)CCCC)cc(cc2)NS(=O)(=O)C' "dry-ice": 'O=C=O' "dtbpe": 'CC(P(C(C)(C)C)CCP(C(C)(C)C)C(C)(C)C)(C)C' "duloxetine": 'CNCCC(c1cccs1)Oc1cccc2c1cccc2' "duroquinone": 'CC1=C(C)C(=O)C(=C(C1=O)C)C' "dutasteride": 'O=C1C=CC2(C(N1)CCC1C2CCC2(C1CCC2C(=O)Nc1cc(ccc1C(F)(F)F)C(F)(F)F)C)C' "dydrogesterone": 'O=C1CCC2(C(=C1)C=CC1C2CCC2(C1CCC2C(=O)C)C)C' "ebpe": 'CC(c1ccccc1)NCCNC(c1ccccc1)C' "ebselen": 'O=c1c2ccccc2[se]n1c1ccccc1' "ecstasy": 'CNC(Cc1ccc2c(c1)OCO2)C' "ecteinascidin": 'COc1cc2c(cc1O)CCNC12CSC2c3c(OC(=O)C)c(C)c4c(c3C(COC1=O)N1C2C2N(C(C1O)Cc1c2c(O)c(c(c1)C)OC)C)OCO4' "ectoine": 'OC(=O)C1CCN=C(N1)C' "edaravone": 'O=C1CC(=NN1c1ccccc1)C' "edoxaban": 'CN1CCc2c(C1)sc(n2)C(=O)NC1CC(CCC1NC(=O)C(=O)Nc1ccc(cn1)Cl)C(=O)N(C)C' "efaroxan": 'CCC1(Cc2c(O1)cccc2)C1=NCCN1' "efavirenz": 'FC(C1(C#CC2CC2)OC(=O)Nc2c1cc(Cl)cc2)(F)F' "eflornithine": 'NCCCC(C(=O)O)(C(F)F)N' "elacridar": 'COc1cc2CN(CCc3ccc(cc3)NC(=O)c3cccc4c3[nH]c3c(OC)cccc3c4=O)CCc2cc1OC' "eldecalcitol": 'OCCCOC1C(O)CC(=CC=C2CCCC3(C2CCC3C(CCCC(O)(C)C)C)C)C(=C)C1O' "elemol": 'C=CC1(C)CCC(CC1C(=C)C)C(O)(C)C' "elisidepsin": 'NCCCC(C(=O)NC(C(=O)NC1C(C)OC(=O)C(NC(=O)C(=CC)NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)C(CC)C)C(C)C)Cc1ccccc1)C(C)C)C(CC)C)NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)C(C(O)C)NC(=O)C(C(C)C)NC(=O)CCC(CC)C' "elvitegravir": 'OCC(n1cc(C(=O)O)c(=O)c2c1cc(OC)c(c2)Cc1cccc(c1F)Cl)C(C)C' "elzasonan": 'CN1CCN(CC1)c1ccccc1C=C1SCCN(C1=O)c1ccc(c(c1)Cl)Cl' "embelin": 'CCCCCCCCCCCC1=C(O)C(=O)C=C(C1=O)O' "emetine": 'CCC1CN2CCc3c(C2CC1CC1NCCc2c1cc(OC)c(c2)OC)cc(c(c3)OC)OC' "emim": 'CCn1cc[n+](c1)C' "emodin": 'Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O' "emodinol": 'Cc1cc2Cc3cc(O)cc(c3C(=O)c2c(c1)O)O' "emtricitabine": 'Nc1nc(=O)n(cc1F)C1CSC(O1)CO' "enalapril": 'CCOC(=O)C(NC(C(=O)N1CCCC1C(=O)O)C)CCc1ccccc1' "enalaprilate": 'OC(=O)C(NC(C(=O)N1CCCC1C(=O)O)C)CCc1ccccc1' "endomorphin-1": 'Oc1ccc(cc1)CC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)N)Cc1ccccc1)Cc1c[nH]c2c1cccc2)N' "endosulfan": 'O=S1OCC2C(CO1)C1(C(C2(Cl)C(=C1Cl)Cl)(Cl)Cl)Cl' "enmein": 'OC1OCC23C1C(C)(C)C(CC2OC(=O)C12C3CCC(C1)C(=C)C2=O)O' "enrofloxacin": 'CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)O' "ent-kaurane": 'CC1CC23CC1CCC3C1(C(CC2)C(C)(C)CCC1)C' "ent-sandwicensin": 'COc1ccc2c(c1CC=C(C)C)OC1C2COc2c1ccc(c2)O' "entecavir": 'OCC1C(O)CC(C1=C)n1cnc2c1[nH]c(N)nc2=O' "enterodiol": 'OCC(C(Cc1cccc(c1)O)CO)Cc1cccc(c1)O' "enzalutamide": 'CNC(=O)c1ccc(cc1F)N1C(=S)N(C(=O)C1(C)C)c1ccc(c(c1)C(F)(F)F)C#N' "eperezolid": 'OCC(=O)N1CCN(CC1)c1ccc(cc1F)N1CC(OC1=O)CNC(=O)C' "epichlorohydrin": 'ClCC1CO1' "epigallocatechin": 'Oc1cc2OC(c3cc(O)c(c(c3)O)O)C(Cc2c(c1)O)O' "epinephrine": 'CNCC(c1ccc(c(c1)O)O)O' "epiroprim": 'CCOc1cc(cc(c1n1cccc1)OCC)Cc1cnc(nc1N)N' "epirubicin": 'OCC(=O)C1(O)CC(OC2CC(N)C(C(O2)C)O)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2OC' "eplerenone": 'COC(=O)C1CC2=CC(=O)CCC2(C23C1C1CCC4(C1(C)CC3O2)CCC(=O)O4)C' "eprosartan": 'CCCCc1ncc(n1Cc1ccc(cc1)C(=O)O)C=C(C(=O)O)Cc1cccs1' "erdosteine": 'O=C(NC1CCSC1=O)CSCC(=O)O' "ergoline": 'C1CNC2C(C1)c1cccc3c1c(C2)c[nH]3' "ergone": 'CC(C(C=CC(C1CCC2=C3C(CCC12C)C1(C)CCC(=O)C=C1C=C3)C)C)C' "ergosterol": 'OC1CCC2(C(=CC=C3C2CCC2(C3CCC2C(C=CC(C(C)C)C)C)C)C1)C' "eribulin": 'NCC(CC1OC2C(C1OC)CC(=O)CC1CCC3C(O1)C1OC4(CCC5OC(CCC6OC(C2)C(=C)C(C6)C)C(=C)C5)OC2C(O3)C1OC2C4)O' "erlotinib": 'COCCOc1cc2c(ncnc2cc1OCCOC)Nc1cccc(c1)C#C' "ertapenem": 'O=C(C1NCC(C1)SC1=C(C(=O)O)N2C(C1C)C(C2=O)C(O)C)Nc1cccc(c1)C(=O)O' "ertugliflozin": 'CCOc1ccc(cc1)Cc1cc(ccc1Cl)C12OCC(O1)(CO)C(C(C2O)O)O' "erucin": 'CSCCCCN=C=S' "erythrodiol": 'OCC12CCC3(C(=CCC4C3(C)CCC3C4(C)CCC(C3(C)C)O)C2CC(CC1)(C)C)C' "erythromycin": 'CCC1OC(=O)C(C)C(OC2OC(C)C(C(C2)(C)OC)O)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(CC(C(=O)C(C(C1(C)O)O)C)C)(C)O' "escitalopram": 'N#Cc1ccc2c(c1)COC2(CCCN(C)C)c1ccc(cc1)F' "esculetin": 'O=c1ccc2c(o1)cc(c(c2)O)O' "esculin": 'OCC1OC(Oc2cc3ccc(=O)oc3cc2O)C(C(C1O)O)O' "eseroline": 'CN1CCC2(C1N(C)c1c2cc(cc1)O)C' "esfenvalerate": 'N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C(c1ccc(cc1)Cl)C(C)C' "estradiol": 'Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2O)C' "estriol": 'Oc1ccc2c(c1)CCC1C2CCC2(C1CC(C2O)O)C' "estrone": 'Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2=O)C' "etazolate": 'CCOC(=O)c1cnc2c(c1NN=C(C)C)cnn2CC' "ethambutol": 'CCC(NCCNC(CO)CC)CO' "ethanol": 'CCO' "ethephon": 'ClCCP(=O)(O)O' "ethidium": 'CC[n+]1c(c2ccccc2)c2cc(N)ccc2c2c1cc(N)cc2' "ethion": 'CCOP(=S)(OCC)SCSP(=S)(OCC)OCC' "ethoprophos": 'CCCSP(=O)(SCCC)OCC' "ethosuximide": 'CC1(CC)CC(=O)NC1=O' "eticlopride": 'CCN1CCCC1CNC(=O)c1c(O)c(CC)cc(c1OC)Cl' "etoposide": 'COc1cc(cc(c1O)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)OC1OC2COC(OC2C(C1O)O)C' "etravirine": 'N#Cc1ccc(cc1)Nc1nc(N)c(c(n1)Oc1c(C)cc(cc1C)C#N)Br' "eucalyptol": 'CC12CCC(CC1)C(O2)(C)C' "eudesmane": 'CC1CCCC2(C1CC(CC2)C(C)C)C' "eudesmanolide": 'O=C1OC2C(C1=C)CC1(C(C2)(C)CCCC1=C)O' "eugenol": 'C=CCc1ccc(c(c1)OC)O' "eunicellin": 'CC(=O)OC1CCC(C)(OC(=O)C)C2OC(CC1=C)C1C2C(CC(C1(C)OC(=O)C)OC(=O)C)C(C)C' "eupomatenoid-3": 'CC=Cc1ccc2c(c1)c(C)c(o2)c1ccc2c(c1)OCO2' "eupomatenoid-5": 'CC=Cc1ccc2c(c1)c(C)c(o2)c1ccc(c(c1)OC)O' "everolimus": 'OCCOC1CCC(CC1OC)CC(C1OC(=O)C2CCCCN2C(=O)C(=O)C2(O)OC(CCC2C)CC(OC)C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)C1)C)C)O)OC)C)C)C)C' "evodiamine": 'O=C1c2ccccc2N(C2N1CCc1c2[nH]c2c1cccc2)C' "evodine": 'COc1c(OCC(C(=C)C)O)ccc2c1nc1occc1c2OC' "exemestane": 'O=C1C=CC2(C(=C1)C(=C)CC1C2CCC2(C1CCC2=O)C)C' "ezetimibe": 'Oc1ccc(cc1)C1C(CCC(c2ccc(cc2)F)O)C(=O)N1c1ccc(cc1)F' "ezogabine": 'CCOC(=O)Nc1ccc(cc1N)NCc1ccc(cc1)F' "fMLF": 'CSCCC(C(=O)NC(C(=O)NC(C(=O)O)Cc1ccccc1)CC(C)C)NC=O' "fadrozole": 'N#Cc1ccc(cc1)C1CCCc2n1cnc2' "fagopyrin": 'Oc1c(C2CCCCN2)c(O)c2c3c1C(=O)c1c(O)cc(c4c1c3c1c3c2c(O)c(C2CCCCN2)c(c3C(=O)c2c1c4c(C)cc2O)O)C' "fampridine": 'Nc1ccncc1' "farnesyl": 'CC=C(CCC=C(CCC=C(C)C)C)C' "fasudil": 'O=S(=O)(c1cccc2c1ccnc2)N1CCNCCC1' "fawcettimine": 'CC1CC2CC(=O)C3C42C(C1)(O)N(CCC3)CCC4' "felbamate": 'NC(=O)OCC(c1ccccc1)COC(=O)N' "felodipine": 'CCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1Cl)Cl)C(=O)OC)C' "fenamiphos": 'CCOP(=O)(Oc1ccc(c(c1)C)SC)NC(C)C' "fenbendazole": 'COC(=O)Nc1nc2c([nH]1)cc(cc2)Sc1ccccc1' "fenfluramine": 'CCNC(Cc1cccc(c1)C(F)(F)F)C' "fenhexamid": 'O=C(C1(C)CCCCC1)Nc1ccc(c(c1Cl)Cl)O' "fenitrothion": 'COP(=S)(Oc1ccc(c(c1)C)[N+](=O)[O-])OC' "fenofibrate": 'CC(OC(=O)C(Oc1ccc(cc1)C(=O)c1ccc(cc1)Cl)(C)C)C' "fenoterol": 'CC(Cc1ccc(cc1)O)NCC(c1cc(O)cc(c1)O)O' "fentanyl": 'CCC(=O)N(c1ccccc1)C1CCN(CC1)CCc1ccccc1' "fenvalerate": 'N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C(c1ccc(cc1)Cl)C(C)C' "fexofenadine": 'OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C' "fidarestat": 'O=C1NC(=O)C2(N1)CC(Oc1c2cc(F)cc1)C(=O)N' "finasteride": 'O=C1C=CC2(C(N1)CCC1C2CCC2(C1CCC2C(=O)NC(C)(C)C)C)C' "fingolimod": 'CCCCCCCCc1ccc(cc1)CCC(CO)(CO)N' "fipronil": 'N#Cc1nn(c(c1S(=O)C(F)(F)F)N)c1c(Cl)cc(cc1Cl)C(F)(F)F' "fisetin": 'Oc1ccc2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O' "flavacol": 'CC(Cc1cnc(c(=O)[nH]1)CC(C)C)C' "flavanone": 'O=C1CC(Oc2c1cccc2)c1ccccc1' "flavone": 'O=c1cc(oc2c1cccc2)c1ccccc1' "flavonol": 'O=c1c(O)c(oc2c1cccc2)c1ccccc1' "flecainide": 'O=C(c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F)NCC1CCCCN1' "flomoxef": 'OCCn1nnnc1SCC1=C(C(=O)O)N2C(OC1)C(C2=O)(OC)NC(=O)CSC(F)F' "florfenicol": 'FCC(C(c1ccc(cc1)S(=O)(=O)C)O)NC(=O)C(Cl)Cl' "floroglucinol": 'Oc1cc(O)cc(c1)O' "flubendazole": 'COC(=O)Nc1nc2c([nH]1)cc(cc2)C(=O)c1ccc(cc1)F' "flucloxacillin": 'O=C1C(NC(=O)c2c(C)onc2c2c(F)cccc2Cl)C2N1C(C(=O)O)C(S2)(C)C' "fluconazole": 'Fc1ccc(c(c1)F)C(Cn1cncn1)(Cn1cncn1)O' "fludarabine": 'OCC1OC(C(C1O)O)n1cnc2c1nc(F)nc2N' "fludioxonil": 'N#Cc1c[nH]cc1c1cccc2c1OC(O2)(F)F' "flumazenil": 'CCOC(=O)c1ncn2-c3ccc(cc3C(=O)N(Cc12)C)F' "flumequine": 'Fc1cc2CCC(n3c2c(c1)c(=O)c(c3)C(=O)O)C' "flumorph": 'COc1cc(ccc1OC)C(=CC(=O)N1CCOCC1)c1ccc(cc1)F' "flunisolide": 'OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CC(C1=CC(=O)C=CC21C)F)(C)C' "fluorescamine": 'O=C1OC2(c3c1cccc3)OC=C(C2=O)c1ccccc1' "fluorescein": 'Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)ccc(c1)O' "fluoxetine": 'CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F' "flurazepam": 'CCN(CCN1C(=O)CN=C(c2c1ccc(c2)Cl)c1ccccc1F)CC' "flurbiprofen": 'OC(=O)C(c1ccc(c(c1)F)c1ccccc1)C' "flusilazole": 'Fc1ccc(cc1)[Si](c1ccc(cc1)F)(Cn1cncn1)C' "flutamide": 'O=C(C(C)C)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-]' "fluticasone": 'FCSC(=O)C1(O)C(C)CC2C1(C)CC(O)C1(C2CC(C2=CC(=O)C=CC12C)F)F' "folate": 'OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(=O)nc([nH]2)N' "formalin": 'C=O' "forskolin": 'C=CC1(C)CC(=O)C2(C(O1)(C)C(OC(=O)C)C(C1C2(C)C(O)CCC1(C)C)O)O' "fosmidomycin": 'O=CN(CCCP(=O)(O)O)O' "fosphenytoin": 'O=C1N(COP(=O)(O)O)C(=O)NC1(c1ccccc1)c1ccccc1' "fostamatinib": 'COc1cc(Nc2ncc(c(n2)Nc2ccc3c(n2)N(COP(=O)(O)O)C(=O)C(O3)(C)C)F)cc(c1OC)OC' "fredericamycin": 'CC=CC=Cc1[nH]c(=O)c2c(c1)cc1c(c2O)C2(CC1)C(=O)c1c(C2=O)c(O)c2c(c1O)C(=O)C=C(C2=O)OC' "friedelin": 'O=C1CCC2C(C1C)(C)CCC1C2(C)CCC2(C1(C)CCC1(C2CC(C)(C)CC1)C)C' "friedeline": 'O=C1CCC2C(C1C)(C)CCC1C2(C)CCC2(C1(C)CCC1(C2CC(C)(C)CC1)C)C' "fructose": 'OCC1(O)OCC(C(C1O)O)O' "fucoxanthin": 'CC(=CC=CC=C(C=CC=C(C(=O)CC12OC2(C)CC(CC1(C)C)O)C)C)C=CC=C(C=C=C1C(C)(C)CC(CC1(C)O)OC(=O)C)C' "fudosteine": 'OCCCSCC(C(=O)O)N' "fullerene": 'c12c3c4c5c2c2c6c7c1c1c8c3c3c9c4c4c%10c5c5c2c2c6c6c%11c7c1c1c7c8c3c3c8c9c4c4c9c%10c5c5c2c2c6c6c%11c1c1c7c3c3c8c4c4c9c5c2c2c6c1c3c42' "fulvestrant": 'O=S(CCCC(C(F)(F)F)(F)F)CCCCCCCCCC1Cc2cc(O)ccc2C2C1C1CCC(C1(CC2)C)O' "fumarate": '[O-]C(=O)C=CC(=O)[O-]' "furan": 'c1ccco1' "furfural": 'O=Cc1ccco1' "furosemide": 'OC(=O)c1cc(c(cc1NCc1ccco1)Cl)S(=O)(=O)N' "furostanol": 'OCC(CCC1OC2C(C1C)C1(C(C2)C2CCC3C(C2CC1)(C)CCCC3)C)C' "gabapentin": 'NCC1(CCCCC1)CC(=O)O' "gaboxadol": 'O=c1[nH]oc2c1CCNC2' "gagaminine": 'O=C(OC1CC2C3(C)CCC(CC3=CCC2(C2(C1(C)C(O)(CC2)C(OC(=O)c1cccnc1)C)O)O)O)C=Cc1ccccc1' "galactitol": 'OCC(C(C(C(CO)O)O)O)O' "galactose": 'OCC1OC(O)C(C(C1O)O)O' "galangin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccccc1' "galantamine": 'COc1ccc2c3c1OC1C3(CCN(C2)C)C=CC(C1)O' "galanthamine": 'COc1ccc2c3c1OC1C3(CCN(C2)C)C=CC(C1)O' "gallamine": 'CCN(CCOc1c(OCCN(CC)CC)cccc1OCCN(CC)CC)CC' "gallate": 'OC(=O)c1cc(O)c(c(c1)O)O' "gallein": 'O=C1OC2(c3c1cccc3)c1ccc(c(c1Oc1c2ccc(c1O)O)O)O' "gamma-HCH": 'ClC1C(Cl)C(Cl)C(C(C1Cl)Cl)Cl' "gamma-glutamyl-cysteine": 'SCC(C(=O)O)NC(=O)CCC(C(=O)O)N' "ganciclovir": 'OCC(OCn1cnc2c1[nH]c(N)nc2=O)CO' "ganodermanondiol": 'CC(C1CCC2(C1(C)CC=C1C2=CCC2C1(C)CCC(=O)C2(C)C)C)CCC(C(O)(C)C)O' "garbogiol": 'CC1Oc2c(C1(C)C)c1oc3c(O)ccc(c3c(=O)c1c(c2)O)O' "gastrodin": 'OCC1OC(Oc2ccc(cc2)CO)C(C(C1O)O)O' "gefitinib": 'COc1cc2ncnc(c2cc1OCCCN1CCOCC1)Nc1ccc(c(c1)Cl)F' "gemcitabine": 'OCC1OC(C(C1O)(F)F)n1ccc(nc1=O)N' "gemfibrozil": 'Cc1ccc(c(c1)OCCCC(C(=O)O)(C)C)C' "gemifloxacin": 'NCC1CN(CC1=NOC)c1nc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)O' "genipin": 'COC(=O)C1=COC(C2C1CC=C2CO)O' "genistein": 'Oc1ccc(cc1)c1coc2c(c1=O)c(O)cc(c2)O' "genistin": 'OCC1OC(Oc2cc(O)c3c(c2)occ(c3=O)c2ccc(cc2)O)C(C(C1O)O)O' "gentianine": 'C=Cc1cncc2c1CCOC2=O' "gentiopicrin": 'C=CC1C(OC=C2C1=CCOC2=O)OC1OC(CO)C(C(C1O)O)O' "gentisate": 'Oc1ccc(c(c1)C(=O)O)O' "geranial": 'O=CC=C(CCC=C(C)C)C' "geraniol": 'OCC=C(CCC=C(C)C)C' "gimatecan": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccccc4c(c3Cn1c2=O)C=NOC(C)(C)C' "ginkgetin": 'COc1ccc(cc1c1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O)c1cc(=O)c2c(o1)cc(cc2O)OC' "glabranin": 'CC(=CCc1c(O)cc(c2c1OC(CC2=O)c1ccccc1)O)C' "glabridin": 'Oc1ccc(c(c1)O)C1COc2c(C1)ccc1c2C=CC(O1)(C)C' "glaucine": 'COc1cc2-c3c(OC)c(OC)cc4c3C(Cc2cc1OC)N(C)CC4' "glibenclamide": 'COc1ccc(cc1C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1)Cl' "gliclazide": 'O=C(NS(=O)(=O)c1ccc(cc1)C)NN1CC2C(C1)CCC2' "glimepiride": 'CCC1=C(C)CN(C1=O)C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCC(CC1)C' "glipizide": 'Cc1ncc(nc1)C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1' "globuxanthone": 'C=CC(c1cc(O)c(c2c1oc1c(O)cccc1c2=O)O)(C)C' "glucosamine": 'OCC1OC(O)C(C(C1O)O)N' "glucose": 'OCC1OC(O)C(C(C1O)O)O' "glucovanillin": 'OCC1OC(Oc2ccc(cc2OC)C=O)C(C(C1O)O)O' "glucuronide": 'O=C(OC1OC(C(=O)O)C(C(C1O)O)O)C=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C' "glutamide": 'NC(=O)CCC(C(=O)[O-])[NH3+]' "glutamine": 'NC(=O)CCC(C(=O)O)N' "glutamylcysteine": 'SCC(C(=O)O)NC(=O)C(CCC(=O)O)N' "glutaraldehyde": 'O=CCCCC=O' "glutathion": 'SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N' "glutathione": 'SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N' "gluthathione": 'SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N' "gly-gly-lys": 'NCCCCC(C(=O)O)NC(=O)CNC(=O)CN' "glybenclamide": 'COc1ccc(cc1C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1)Cl' "glyburide": 'COc1ccc(cc1C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1)Cl' "glyceraldehyde": 'OC(C=O)CO' "glycerol": 'OCC(CO)O' "glycidamide": 'NC(=O)C1CO1' "glycidol": 'OCC1CO1' "glycine": 'NCC(=O)O' "glycitin": 'OCC1OC(Oc2cc3occ(c(=O)c3cc2OC)c2ccc(cc2)O)C(C(C1O)O)O' "glycocyamidine": 'O=C1CN=C(N1)N' "glycodeoxycholate": 'OC1CCC2(C(C1)CCC1C2CC(O)C2(C1CCC2C(CCC(=O)NCC(=O)O)C)C)C' "glycolaldehyde": 'OCC=O' "glycyl-sarcosine": 'CN(C(=O)CN)CC(=O)O' "glycylglycine": 'NCC(=O)NCC(=O)O' "glycylsarcosine": 'CN(C(=O)CN)CC(=O)O' "glyoxal": 'O=CC=O' "glyphosate": 'OC(=O)CNCP(=O)(O)O' "gossypol": 'O=Cc1c(O)c(O)c(c2c1c(O)c(c(c2)C)c1c(C)cc2c(c1O)c(C=O)c(c(c2C(C)C)O)O)C(C)C' "graphene": '[C]' "graphite": '[C]' "grifolin": 'CC(=CCc1c(O)cc(cc1O)C)CCC=C(CCC=C(C)C)C' "griseofulvin": 'COC1=CC(=O)CC(C21Oc1c(C2=O)c(OC)cc(c1Cl)OC)C' "gua": 'Nc1[nH]c(=O)c2c(n1)[nH]cn2' "guaiacol": 'COc1ccccc1O' "guanfacine": 'O=C(Cc1c(Cl)cccc1Cl)N=C(N)N' "guanidine": 'NC(=N)N' "guanine": 'Nc1nc(=O)c2c([nH]1)nc[nH]2' "guanosine": 'OCC1OC(C(C1O)O)n1cnc2c1[nH]c(N)nc2=O' "guanylate": 'OC1C(O)C(OC1n1cnc2c1[nH]c(N)nc2=O)COP(=O)(O)O' "guo": 'OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N)[nH]c2=O' "haematoxylin": 'Oc1cc2CC3(C(c2cc1O)c1ccc(c(c1OC3)O)O)O' "haloperidol": 'Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl' "harmaline": 'COc1ccc2=C3C(=C(C)NCC3)N=c2c1' "helenalin": 'C=C1C(=O)OC2C1C(O)C1(C)C(=O)C=CC1C(C2)C' "hematite": '[O-2].[O-2].[O-2].[Fe+3].[Fe+3]' "hemopressin": 'NCCCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)Cc1[nH]cnc1)CO)CC(C)C)Cc1ccccc1)NC(=O)C(NC(=O)C(NC(=O)C(C(C)C)NC(=O)C1CCCN1)CC(=O)N)Cc1ccccc1' "heptachlor": 'ClC1C=CC2C1C1(Cl)C(=C(C2(C1(Cl)Cl)Cl)Cl)Cl' "herboxidiene": 'COC(C(C1OC1(C)CC(C=CC=C(C1OC(CCC1C)CC(=O)O)C)C)C)C(O)C' "heroin": 'CC(=O)OC1C=CC2C34C1Oc1c4c(CC2N(CC3)C)ccc1OC(=O)C' "hesperidin": 'COc1ccc(cc1O)C1CC(=O)c2c(O1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "hexaconazole": 'CCCCC(c1ccc(cc1Cl)Cl)(Cn1cncn1)O' "hexane": 'CCCCCC' "hinokitiol": 'CC(c1cccc(c(=O)c1)O)C' "hippeastrine": 'CN1CCC2=CC(C3C(C12)c1cc2OCOc2cc1C(=O)O3)O' "hirsutanonol": 'OC(CC(=O)CCc1ccc(c(c1)O)O)CCc1ccc(c(c1)O)O' "hirsutenone": 'O=C(CCc1ccc(c(c1)O)O)C=CCCc1ccc(c(c1)O)O' "histamine": 'NCCc1cnc[nH]1' "histidine": 'NC(C(=O)O)Cc1cnc[nH]1' "hmpa": 'CN(P(=O)(N(C)C)N(C)C)C' "hmta": 'C1N2CN3CN1CN(C2)C3' "honokiol": 'C=CCc1ccc(c(c1)c1ccc(c(c1)CC=C)O)O' "hopane": 'CC(C1CCC2(C1CCC1(C2CCC2C1(C)CCC1C2(C)CCCC1(C)C)C)C)C' "hopene": 'CC(=C)C1CCC2(C1CCC1(C2CCC2C1(C)CCC1C2(C)CCCC1(C)C)C)C' "hycanthone": 'CCN(CCNc1ccc(c2c1c(=O)c1c(s2)cccc1)CO)CC' "hydantoin": 'O=C1NCC(=O)N1' "hydrocodone": 'COc1ccc2c3c1OC1C43CCN(C(C2)C4CCC1=O)C' "hydrocortisone": 'OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C' "hydroxyapatite": '[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[OH-]' "hydroxyflutamide": 'O=C(C(O)(C)C)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-]' "hymexazol": 'Cc1cc(=O)[nH]o1' "hyperforin": 'CC(=CCCC1(C)C(CC=C(C)C)CC2(C(=O)C1(C(=O)C(C)C)C(=O)C(=C2O)CC=C(C)C)CC=C(C)C)C' "hypericin": 'Oc1cc(C)c2c3c1C(=O)c1c(O)cc(c4c1c3c1c3c2c(C)cc(c3C(=O)c2c1c4c(O)cc2O)O)O' "hyperoside": 'OCC1OC(Oc2c(oc3c(c2=O)c(O)cc(c3)O)c2ccc(c(c2)O)O)C(C(C1O)O)O' "hypotaurine": 'NCCS(=O)O' "hypoxanthine": 'O=c1nc[nH]c2c1[nH]cn2' "i-PrOH": 'CC(O)C' "iPrOH": 'CC(O)C' "ibandronate": 'CCCCCN(CCC(P(=O)(O)O)(P(=O)(O)O)O)C' "iberin": 'S=C=NCCCS(=O)C' "iberverin": 'CSCCCN=C=S' "ibuprofen": 'CC(Cc1ccc(cc1)C(C(=O)O)C)C' "ibuprophen": 'CC(Cc1ccc(cc1)C(C(=O)O)C)C' "icariin": 'COc1ccc(cc1)c1oc2c(CC=C(C)C)c(OC3OC(CO)C(C(C3O)O)O)cc(c2c(=O)c1OC1OC(C)C(C(C1O)O)O)O' "icilin": 'O=C1NC(=CCN1c1ccccc1O)c1cccc(c1)[N+](=O)[O-]' "idazoxan": 'C1CN=C(N1)C1COc2c(O1)cccc2' "idebenone": 'OCCCCCCCCCCC1=C(C)C(=O)C(=C(C1=O)OC)OC' "ifenprodil": 'Oc1ccc(cc1)C(C(N1CCC(CC1)Cc1ccccc1)C)O' "ifosfamide": 'ClCCNP1(=O)OCCCN1CCCl' "iloperidone": 'COc1cc(ccc1OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C(=O)C' "imatinib": 'CN1CCN(CC1)Cc1ccc(cc1)C(=O)Nc1ccc(c(c1)Nc1nccc(n1)c1cccnc1)C' "imazalil": 'C=CCOC(c1ccc(cc1Cl)Cl)Cn1cncc1' "imidacloprid": '[O-][N+](=O)NC1=NCCN1Cc1ccc(nc1)Cl' "imipenem": 'CC(C1C2CC(=C(N2C1=O)C(=O)O)SCCN=CN)O' "imipramine": 'CN(CCCN1c2ccccc2CCc2c1cccc2)C' "imperatorin": 'CC(=CCOc1c2occc2cc2c1oc(=O)cc2)C' "indene": 'c1ccc2c(c1)C=CC2' "indinavir": 'OC(CN1CCN(CC1C(=O)NC(C)(C)C)Cc1cccnc1)CC(C(=O)NC1C(O)Cc2c1cccc2)Cc1ccccc1' "indolamine": 'Nc1c[nH]c2c1cccc2' "indomethacin": 'COc1ccc2c(c1)c(CC(=O)O)c(n2C(=O)c1ccc(cc1)Cl)C' "ingliforib": 'OC1CN(CC1O)C(=O)C(C(NC(=O)c1cc2c([nH]1)ccc(c2)Cl)Cc1ccccc1)O' "inosine": 'OCC1OC(C(C1O)O)n1cnc2c1[nH]cnc2=O' "inositol": 'OC1C(O)C(O)C(C(C1O)O)O' "iodiconazole": 'CN(CC(c1ccc(cc1F)F)(Cn1ncnc1)O)Cc1ccc(cc1)I' "iodogen": 'ClN1C(=O)N(C2(C1(c1ccccc1)N(Cl)C(=O)N2Cl)c1ccccc1)Cl' "iprodione": 'CC(NC(=O)N1CC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl)C' "irbesartan": 'CCCCC1=NC2(C(=O)N1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CCCC2' "irgarol": 'CSc1nc(NC2CC2)nc(n1)NC(C)(C)C' "irinotecan": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(cc4c(c3Cn1c2=O)CC)OC(=O)N1CCC(CC1)N1CCCCC1' "isatin": 'O=C1C(=O)Nc2c1cccc2' "isn": 'NC(=O)c1ccncc1' "isoacteoside": 'O=C(OCC1OC(OCCc2ccc(c(c2)O)O)C(C(C1O)OC1OC(C)C(C(C1O)O)O)O)C=Cc1ccc(c(c1)O)O' "isoambreinolide": 'O=C1CCC2(O1)C(C)CCC1C2(C)CCCC1(C)C' "isocorilagin": 'OC1C2COC(=O)c3cc(O)c(c(c3-c3c(C(=O)OC1C(C(O2)OC(=O)c1cc(O)c(c(c1)O)O)O)cc(O)c(c3O)O)O)O' "isocoumarin": 'O=c1occc2c1cccc2' "isocytosine": 'Nc1nccc(=O)[nH]1' "isoengeletin": 'Oc1ccc(cc1)C1Oc2cc(O)cc(c2C(=O)C1OC1OC(C)C(C(C1O)O)O)O' "isoeugenol": 'CC=Cc1ccc(c(c1)OC)O' "isoflurane": 'FC(OC(C(F)(F)F)Cl)F' "isoidide": 'OC1COC2C1OCC2O' "isoimperatorin": 'CC(=CCOc1c2ccoc2cc2c1ccc(=O)o2)C' "isolariciresinol": 'OCC1Cc2cc(OC)c(cc2C(C1CO)c1ccc(c(c1)OC)O)O' "isoleucine": 'CCC(C(C(=O)O)N)C' "isoliquiritigenin": 'Oc1ccc(cc1)C=CC(=O)c1ccc(cc1O)O' "isoliquiritin": 'OCC1OC(Oc2ccc(cc2)C=CC(=O)c2ccc(cc2O)O)C(C(C1O)O)O' "isoliquirtigenin": 'Oc1ccc(cc1)C=CC(=O)c1ccc(cc1O)O' "isomelezitose": 'OCC1OC(OCC2OC(C(C2O)O)(CO)OC2OC(CO)C(C(C2O)O)O)C(C(C1O)O)O' "isomenthone": 'CC1CCC(C(=O)C1)C(C)C' "isoniazid": 'NNC(=O)c1ccncc1' "isoorientin": 'OCC1OC(C(C(C1O)O)O)c1c(O)cc2c(c1O)c(=O)cc(o2)c1ccc(c(c1)O)O' "isoprene": 'C=CC(=C)C' "isoproterenol": 'CC(NCC(c1ccc(c(c1)O)O)O)C' "isoproturon": 'O=C(N(C)C)Nc1ccc(cc1)C(C)C' "isopulegone": 'CC1CCC(C(=O)C1)C(=C)C' "isoquercitrin": 'OCC1OC(Oc2c(oc3c(c2=O)c(O)cc(c3)O)c2ccc(c(c2)O)O)C(C(C1O)O)O' "isorhamnetin": 'COc1cc(ccc1O)c1oc2cc(O)cc(c2c(=O)c1O)O' "isosorbide": 'OC1COC2C1OCC2O' "isosteviol": 'OC(=O)C1(C)CCCC2(C1CCC13C2CCC(C3)(C(=O)C1)C)C' "isotretinoin": 'CC(=CC=CC(=CC(=O)O)C)C=CC1=C(C)CCCC1(C)C' "isovaleryl": '[CH2-]C(=C)CC#[O+]' "isovitexin": 'OCC1OC(C(C(C1O)O)O)c1c(O)cc2c(c1O)c(=O)cc(o2)c1ccc(cc1)O' "isradipine": 'COC(=O)C1=C(C)NC(=C(C1c1cccc2c1non2)C(=O)OC(C)C)C' "istaroxime": 'NCCON=C1CCC2(C(C1)C(=O)CC1C2CCC2(C1CCC2=O)C)C' "ivabradine": 'COc1cc2CC(c2cc1OC)CN(CCCN1CCc2c(CC1=O)cc(c(c2)OC)OC)C' "ixabepilone": 'O=C1NC(CC2OC2(C)CCCC(C(C(C(=O)C(C(C1)O)(C)C)C)O)C)C(=Cc1csc(n1)C)C' "jaceosidin": 'COc1cc(ccc1O)c1cc(=O)c2c(o1)cc(c(c2O)OC)O' "jatrorrhizine": 'COc1cc2-c3cc4ccc(c(c4c[n+]3CCc2cc1O)OC)OC' "juglone": 'O=C1C=CC(=O)c2c1c(O)ccc2' "kaempferol": 'Oc1ccc(cc1)c1oc2cc(O)cc(c2c(=O)c1O)O' "kaempherol": 'Oc1ccc(cc1)c1oc2cc(O)cc(c2c(=O)c1O)O' "kainate": 'OC(=O)CC1C(CNC1C(=O)O)C(=C)C' "kampferol": 'Oc1ccc(cc1)c1oc2cc(O)cc(c2c(=O)c1O)O' "kaolin": 'O=[Al]O[Si](=O)O[Si](=O)O[Al]=O.O.O' "kaolinite": 'O=[Al]O[Al]=O.O=[Si]=O' "ketamine": 'CNC1(CCCCC1=O)c1ccccc1Cl' "ketanserin": 'Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2' "ketoprofen": 'OC(=O)C(c1cccc(c1)C(=O)c1ccccc1)C' "ketorolac": 'OC(=O)C1CCn2c1ccc2C(=O)c1ccccc1' "ketotifen": 'CN1CCC(=C2c3ccccc3CC(=O)c3c2ccs3)CC1' "kinsenoside": 'OCC1OC(OC2COC(=O)C2)C(C(C1O)O)O' "kutkin": 'OCC1OC(OC(=O)c2ccc(c(c2)OC)OC(=O)C=Cc2ccccc2)C(C(C1O)O)O.O.O' "kynurenine": 'OC(=O)C(CC(=O)c1ccccc1N)N' "l-Arg": 'OC(=O)C(CCCN=C(N)N)N' "l-Carnitine": 'OC(C[N+](C)(C)C)CC(=O)[O-]' "l-Cystine": 'NC(C(=O)O)CSSCC(C(=O)O)N' "l-DOPA": 'OC(=O)C(Cc1ccc(c(c1)O)O)N' "l-NAME": 'COC(=O)C(CCCN=C(N[N+](=O)[O-])N)N' "l-Pro": '[O-]C(=O)C1CCC[NH2+]1' "l-Tyrosine": 'OC(=O)C(Cc1ccc(cc1)O)N' "l-allylglycine": 'NC(C(=O)O)CC=C' "l-arginine": 'OC(=O)C(CCCN=C(N)N)N' "l-carnitine": 'OC(C[N+](C)(C)C)CC(=O)[O-]' "l-cysteine": 'NC(C(=O)O)CS' "l-cystine": 'NC(C(=O)O)CSSCC(C(=O)O)N' "l-dopa": 'OC(=O)C(Cc1ccc(c(c1)O)O)N' "l-glutamine": 'NC(=O)CCC(C(=O)O)N' "l-histidine": 'NC(C(=O)O)Cc1cnc[nH]1' "l-isoleucine": 'CCC(C(C(=O)O)N)C' "l-leucine": 'NC(C(=O)O)CC(C)C' "l-leucyl-l-isoleucine": 'CCC(C(C(=O)O)NC(=O)C(CC(C)C)N)C' "l-phe": 'NC(C(=O)O)Cc1ccccc1' "l-phenylalanine": 'NC(C(=O)O)Cc1ccccc1' "l-ribose": 'OCC(C(C(C=O)O)O)O' "l-valine": 'NC(C(=O)O)C(C)C' "labdane": 'CCC(CCC1C(C)CCC2C1(C)CCCC2(C)C)C' "labetalol": 'CC(CCc1ccccc1)NCC(c1ccc(c(c1)C(=O)N)O)O' "lacosamide": 'COCC(C(=O)NCc1ccccc1)NC(=O)C' "lactide": 'CC1OC(=O)C(OC1=O)C' "ladostigil": 'C#CCNC1CCc2c1cc(cc2)OC(=O)N(CC)C' "lagascatriol": 'OCC(C1(C)CC(O)C2(C(C1)CC=C1C2CCCC1(C)C)C)O' "lamivudine": 'Nc1ccn(c(=O)n1)C1CSC(O1)CO' "lamotrigine": 'Nc1nnc(c(n1)N)c1cccc(c1Cl)Cl' "laninamivir": 'OCC(C(C1OC(=CC(C1NC(=O)C)N=C(N)N)C(=O)O)OC)O' "lanostane": 'CC(CCCC(C1CCC2(C1(C)CCC1C2CCC2C1(C)CCCC2(C)C)C)C)C' "lanosterol": 'CC(=CCCC(C1CCC2(C1(C)CCC1=C2CCC2C1(C)CCC(C2(C)C)O)C)C)C' "lansoprazole": 'O=S(c1nc2c([nH]1)cccc2)Cc1nccc(c1C)OCC(F)(F)F' "lapachol": 'CC(=CCC1=C(O)c2c(C(=O)C1=O)cccc2)C' "lapatinib": 'Fc1cccc(c1)COc1ccc(cc1Cl)Nc1ncnc2c1cc(cc2)c1ccc(o1)CNCCS(=O)(=O)C' "laponite": '[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[O-][Si]12O[Si]3([O-])O[Si](O2)(O[Si](O1)(O3)[O-])[O-].[Li+].[Li+].[Na+].[Na+].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-]' "lariciresinol": 'OCC1C(COC1c1ccc(c(c1)OC)O)Cc1ccc(c(c1)OC)O' "laricitrin": 'COc1cc(cc(c1O)O)c1oc2cc(O)cc(c2c(=O)c1O)O' "laropiprant": 'OC(=O)CC1CCc2c1n(Cc1ccc(cc1)Cl)c1c2cc(cc1S(=O)(=O)C)F' "lasiodin": 'CC(=O)OC1CCC(C2C31COC(C2O)(C12C3CCC(C2O)C(=C)C1=O)O)(C)C' "lathosterol": 'CC(CCCC(C1CCC2C1(C)CCC1C2=CCC2C1(C)CCC(C2)O)C)C' "laulimalide": 'C=C1CC(C)CC2CC=CC(O2)CC=CC(=O)OC(CC2C(C(C1)O)O2)C(C=CC1OCC=C(C1)C)O' "laurocapram": 'CCCCCCCCCCCCN1CCCCCC1=O' "laurolitsine": 'COc1cc2-c3c(OC)c(O)cc4c3C(Cc2cc1O)NCC4' "lenalidomide": 'O=C1CCC(C(=O)N1)N1Cc2c(C1=O)cccc2N' "lesogaberan": 'NCC(C[P+](=O)O)F' "lestaurtinib": 'OCC1(O)CC2OC1(C)n1c3c4n2c2ccccc2c4c2c(c3c3c1cccc3)CNC2=O' "letrozole": 'N#Cc1ccc(cc1)C(n1cncn1)c1ccc(cc1)C#N' "leucine": 'NC(C(=O)O)CC(C)C' "leucovorin": 'O=CN1C(CNc2ccc(cc2)C(=O)NC(C(=O)O)CCC(=O)O)CNc2c1c(=O)nc([nH]2)N' "levcromakalim": 'N#Cc1ccc2c(c1)C(N1CCCC1=O)C(C(O2)(C)C)O' "levetiracetam": 'CCC(N1CCCC1=O)C(=O)N' "levitiracetam": 'CCC(N1CCCC1=O)C(=O)N' "levofloxacin": 'CN1CCN(CC1)c1c(F)cc2c3c1OCC(n3cc(c2=O)C(=O)O)C' "levoglucosan": 'OC1C(O)C2COC(C1O)O2' "levonorgestrel": 'C#CC1(O)CCC2C1(CC)CCC1C2CCC2=CC(=O)CCC12' "levosimendan": 'N#CC(=NNc1ccc(cc1)C1=NNC(=O)CC1C)C#N' "levothyroxine": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "levulinate": '[O-]C(=O)CCC(=O)C' "lidocaine": 'CCN(CC(=O)Nc1c(C)cccc1C)CC' "lilial": 'O=CC(Cc1ccc(cc1)C(C)(C)C)C' "limonene": 'CC1=CCC(CC1)C(=C)C' "limonin": 'O=C1OCC23C(C1)OC(C2CC(=O)C1(C3CCC2(C31OC3C(=O)OC2c1cocc1)C)C)(C)C' "linagliptin": 'CC#CCn1c(nc2c1c(=O)n(Cc1nc(C)c3c(n1)cccc3)c(=O)n2C)N1CCCC(C1)N' "linalool": 'C=CC(CCC=C(C)C)(O)C' "linarin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "lincomycin": 'CCCC1CN(C(C1)C(=O)NC(C1OC(SC)C(C(C1O)O)O)C(O)C)C' "lindane": 'ClC1C(Cl)C(Cl)C(C(C1Cl)Cl)Cl' "linezolid": 'CC(=O)NCC1OC(=O)N(C1)c1ccc(c(c1)F)N1CCOCC1' "linoleate": 'CCCCCC=CCC=CCCCCCCCC(=O)O' "linoleic": 'CCCCCC=CCC=CCCCCCCCC(=O)O' "linolenate": 'CCC=CCC=CCC=CCCCCCCCC(=O)O' "liquiritigenin": 'Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2)O' "liquiritin": 'OCC1OC(Oc2ccc(cc2)C2CC(=O)c3c(O2)cc(cc3)O)C(C(C1O)O)O' "liriodenine": 'O=C1c2ccccc2-c2c3c1nccc3cc1c2OCO1' "lisdexamfetamine": 'NCCCCC(C(=O)NC(Cc1ccccc1)C)N' "lisinopril": 'NCCCCC(C(=O)N1CCCC1C(=O)O)NC(C(=O)O)CCc1ccccc1' "lisuride": 'CCN(C(=O)NC1CN(C)C2C(=C1)c1cccc3c1c(C2)c[nH]3)CC' "lobelane": 'CN1C(CCc2ccccc2)CCCC1CCc1ccccc1' "loganin": 'OCC1OC(OC2OC=C(C3C2C(C)C(C3)O)C(=O)OC)C(C(C1O)O)O' "lomefloxacin": 'CCn1cc(C(=O)O)c(=O)c2c1c(F)c(N1CCNC(C1)C)c(c2)F' "lonchocarpine": 'O=C(c1ccc2c(c1O)C=CC(O2)(C)C)C=Cc1ccccc1' "loperamide": 'Clc1ccc(cc1)C1(O)CCN(CC1)CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1' "lopinavir": 'O=C(NC(C(CC(Cc1ccccc1)NC(=O)C(N1CCCNC1=O)C(C)C)O)Cc1ccccc1)COc1c(C)cccc1C' "loratadine": 'CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1' "lorazepam": 'Clc1ccc2c(c1)C(=NC(C(=O)N2)O)c1ccccc1Cl' "lorcaserin": 'Clc1ccc2c(c1)C(C)CNCC2' "lornoxicam": 'Clc1sc2c(c1)S(=O)(=O)N(C(=C2O)C(=O)Nc1ccccn1)C' "losartan": 'CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)CO)Cl' "losmapimod": 'O=C(c1ccc(nc1)c1cc(cc(c1C)F)C(=O)NC1CC1)NCC(C)(C)C' "lovastatin": 'CCC(C(=O)OC1CC(C)C=C2C1C(CCC1CC(O)CC(=O)O1)C(C=C2)C)C' "lucanthone": 'CCN(CCNc1ccc(c2c1c(=O)c1c(s2)cccc1)C)CC' "lucenin-2": 'OCC1OC(C(C(C1O)O)O)c1c(O)c(C2OC(CO)C(C(C2O)O)O)c(c2c1oc(cc2=O)c1ccc(c(c1)O)O)O' "lucidone": 'COC1=CC(=O)C(=C1O)C(=O)C=Cc1ccccc1' "lumefantrine": 'CCCCN(CC(c1cc(Cl)cc2c1-c1ccc(cc1C2=Cc1ccc(cc1)Cl)Cl)O)CCCC' "lumichrome": 'Cc1cc2nc3c(nc2cc1C)[nH]c(=O)[nH]c3=O' "luminal": 'CCC1(C(=O)NC(=O)NC1=O)c1ccccc1' "luminol": 'Nc1cccc2c1c(=O)[nH][nH]c2=O' "lupenone": 'CC(=C)C1CCC2(C1C1CCC3C(C1(C)CC2)(C)CCC1C3(C)CCC(=O)C1(C)C)C' "lupeol": 'CC(=C)C1CCC2(C1C1CCC3C(C1(C)CC2)(C)CCC1C3(C)CCC(C1(C)C)O)C' "lupinifolin": 'CC(=CCc1c2OC(CC(=O)c2c(c2c1OC(C)(C)C=C2)O)c1ccc(cc1)O)C' "lurasidone": 'O=C1N(CC2CCCCC2CN2CCN(CC2)c2nsc3c2cccc3)C(=O)C2C1C1CCC2C1' "lut": 'Cc1ccnc(c1)C' "luteolin": 'Oc1cc(O)c2c(c1)oc(cc2=O)c1ccc(c(c1)O)O' "lycopene": 'CC(=CC=CC=C(C=CC=C(C=CC=C(CCC=C(C)C)C)C)C)C=CC=C(C=CC=C(CCC=C(C)C)C)C' "lycorenine": 'COc1cc2C3C(CC=C4C3N(C)CC4)OC(c2cc1OC)O' "lyral": 'O=CC1CCC(=CC1)CCCC(O)(C)C' "lys": 'NCCCCC(C(=O)O)N' "m-CPBA": 'OOC(=O)c1cccc(c1)Cl' "m-Tolylmagnesium Bromide": 'Br[Mg]c1cccc(c1)C' "mCPBA": 'OOC(=O)c1cccc(c1)Cl' "mPEG": 'COCCO' "macelignan": 'COc1cc(ccc1O)CC(C(Cc1ccc2c(c1)OCO2)C)C' "magnetite": 'O[Fe]=O.O[Fe]=O.[Fe]' "magnolol": 'C=CCc1ccc(c(c1)c1cc(CC=C)ccc1O)O' "malathion": 'CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)OC' "malation": 'CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)OC' "mallotophenone": 'COc1c(Cc2c(OC)c(C)c(c(c2O)C(=O)C)O)c(O)c(c(c1C)O)C(=O)C' "malonaldehyde": 'O=CCC=O' "malonate": '[O-]C(=O)CC(=O)[O-]' "malondialdehyde": 'O=CCC=O' "malononitrile": 'N#CCC#N' "malonyl-CoA": 'O=C(NCCSC(=O)CC(=O)O)CCNC(=O)C(C(COP(=O)(OP(=O)(OCC1OC(C(C1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O' "malvidin": 'COc1cc(cc(c1O)OC)c1[o+]c2cc(O)cc(c2cc1O)O' "man": 'OCC1OC(O)C(C(C1O)O)O' "mangiferin": 'OCC1OC(C(C(C1O)O)O)c1c(O)cc2c(c1O)c(=O)c1c(o2)cc(c(c1)O)O' "mannitol": 'OCC(C(C(C(CO)O)O)O)O' "mannose": 'OCC1OC(O)C(C(C1O)O)O' "maprotiline": 'CNCCCC12CCC(c3c1cccc3)c1c2cccc1' "marimastat": 'ONC(=O)C(C(C(=O)NC(C(C)(C)C)C(=O)NC)CC(C)C)O' "matrine": 'O=C1CCCC2N1CC1CCCN3C1C2CCC3' "mebendazole": 'COC(=O)Nc1nc2c([nH]1)cc(cc2)C(=O)c1ccccc1' "mecamylamine": 'CNC1(C)C2CCC(C1(C)C)C2' "mechlorethamine": 'ClCCN(CCCl)C' "medicagenin": 'CC(=CCc1cc(C(=O)C=Cc2ccc(cc2)O)c(c(c1O)CC=C(C)C)O)C' "medroxyprogesterone": 'O=C1CCC2(C(=C1)C(C)CC1C2CCC2(C1CCC2(O)C(=O)C)C)C' "melamine": 'Nc1nc(N)nc(n1)N' "melatonin": 'COc1ccc2c(c1)c(CCNC(=O)C)c[nH]2' "melittoside": 'OCC1OC(OC2OC=CC3(C2C(=CC3O)CO)OC2OC(CO)C(C(C2O)O)O)C(C(C1O)O)O' "meloxicam": 'Cc1cnc(s1)NC(=O)C1=C(O)c2ccccc2S(=O)(=O)N1C' "melphalan": 'ClCCN(c1ccc(cc1)CC(C(=O)O)N)CCCl' "memantine": 'CC12CC3CC(C1)(C)CC(C2)(C3)N' "menadione": 'O=C1C=C(C)C(=O)c2c1cccc2' "menthol": 'CC1CCC(C(C1)O)C(C)C' "mephedrone": 'CNC(C(=O)c1ccc(cc1)C)C' "meropenem": 'CC(C1C(=O)N2C1C(C)C(=C2C(=O)O)SC1CNC(C1)C(=O)N(C)C)O' "mesalamine": 'Nc1ccc(c(c1)C(=O)O)O' "mesifurane": 'COC1=C(C)OC(C1=O)C' "mesitylene": 'Cc1cc(C)cc(c1)C' "meso-Tetraphenylchlorin": 'c1ccc(cc1)C1=C2CCC(=C(c3ccccc3)C3=NC(=C(c4[nH]c(C(=C5N=C1CC5)c1ccccc1)cc4)c1ccccc1)C=C3)N2' "met-enkephalin": 'CSCCC(C(=O)O)NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)C(Cc1ccc(cc1)O)N' "metformin": 'CN(C(=N)N=C(N)N)C' "metformine": 'CN(C(=N)N=C(N)N)C' "methacholine": 'CC(C[N+](C)(C)C)OC(=O)C' "methacrylate": 'CC(=C)C(=O)[O-]' "methadone": 'CCC(=O)C(c1ccccc1)(c1ccccc1)CC(N(C)C)C' "methamidophos": 'COP(=O)(SC)N' "methamphetamine": 'CNC(Cc1ccccc1)C' "methanabol": 'OC1CCC2(C(=CCC3C2CCC2(C3CCC2(C)O)C)C1)C' "methanol": 'CO' "methapyrilene": 'CN(CCN(c1ccccn1)Cc1cccs1)C' "methazolamide": 'CC(=O)N=c1sc(nn1C)S(=O)(=O)N' "methcathinone": 'CNC(C(=O)c1ccccc1)C' "methenamine": 'C1N2CN3CN1CN(C2)C3' "methicillin": 'COc1cccc(c1C(=O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C)OC' "methidathion": 'COc1sc(=O)n(n1)CSP(=S)(OC)OC' "methimazole": 'Cn1cc[nH]c1=S' "methiocarb": 'CNC(=O)Oc1cc(C)c(c(c1)C)SC' "methiothepin": 'CSc1ccc2c(c1)C(Cc1c(S2)cccc1)N1CCN(CC1)C' "methotrexate": 'OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C' "methoxamine": 'COc1ccc(c(c1)C(C(N)C)O)OC' "methoxychlor": 'COc1ccc(cc1)C(C(Cl)(Cl)Cl)c1ccc(cc1)OC' "methyldopa": 'OC(=O)C(Cc1ccc(c(c1)O)O)(N)C' "methylone": 'CNC(C(=O)c1ccc2c(c1)OCO2)C' "methysergide": 'CCC(NC(=O)C1CN(C)C2C(=C1)c1cccc3c1c(C2)cn3C)CO' "metolachlor": 'COCC(N(c1c(C)cccc1CC)C(=O)CCl)C' "metoprolol": 'COCCc1ccc(cc1)OCC(CNC(C)C)O' "metronidazole": 'OCCn1c(C)ncc1[N+](=O)[O-]' "metyrapone": 'O=C(C(c1cccnc1)(C)C)c1cccnc1' "mibefradil": 'COCC(=O)OC1(CCN(CCCc2nc3c([nH]2)cccc3)C)CCc2c(C1C(C)C)ccc(c2)F' "mica": 'O=[Al]O[Al]=O.O=[Si]=O.[O-2].[K+].[K+]' "miconazole": 'Clc1ccc(c(c1)Cl)COC(c1ccc(cc1Cl)Cl)Cn1cncc1' "microcystin-LR": 'COC(C(C=C(C=CC1NC(=O)C(CCCN=C(N)N)NC(=O)C(C)C(NC(=O)C(CC(C)C)NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC(=O)C1C)C(=O)O)C)C)C(=O)O)C)C)Cc1ccccc1' "microcystin-RR": 'COC(C(C=C(C=CC1NC(=O)C(CCCN=C(N)N)NC(=O)C(C)C(NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC(=O)C1C)C(=O)O)C)C)C(=O)O)C)C)Cc1ccccc1' "midazolam": 'Clc1ccc2-n3c(CN=C(c2c1)c1ccccc1F)cnc3C' "mifepristone": 'CC#CC1(O)CCC2C1(C)CC(c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CCC21' "milnacipran": 'NCC1CC1(c1ccccc1)C(=O)N(CC)CC' "milrinone": 'N#Cc1cc(c2ccncc2)c([nH]c1=O)C' "miltefosine": 'CCCCCCCCCCCCCCCCOP(=O)(OCC[N+](C)(C)C)[O-]' "miltirone": 'CC(C1=Cc2ccc3c(c2C(=O)C1=O)CCCC3(C)C)C' "milveterol": 'O=CNc1cc(ccc1O)C(CNCCc1ccc(cc1)NCC(c1ccccc1)O)O' "minocycline": 'CN(C1C(=O)C(=C(C2(C1CC1Cc3c(C(=C1C2=O)O)c(O)ccc3N(C)C)O)O)C(=O)N)C' "mirex": 'ClC12C(Cl)(Cl)C3(C4(C1(Cl)C1(C2(Cl)C3(C4(C1(Cl)Cl)Cl)Cl)Cl)Cl)Cl' "mirtazapine": 'CN1CCN2C(C1)c1ccccc1Cc1c2nccc1' "misoprostol": 'CCCCC(CC=CC1C(O)CC(=O)C1CCCCCCC(=O)OC)(O)C' "mithramycin": 'COC(C1Cc2cc3cc(OC4OC(C)C(C(C4)OC4CC(O)C(C(O4)C)O)O)c(c(c3c(c2C(=O)C1OC1OC(C)C(C(C1)OC1OC(C)C(C(C1)OC1OC(C)C(C(C1)(C)O)O)O)O)O)O)C)C(=O)C(C(O)C)O' "mitomycin-C": 'COC12C3NC3CN2C2=C(C1COC(=O)N)C(=O)C(=C(C2=O)C)N' "mitoxantrone": 'OCCNCCNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)NCCNCCO' "mitragynine": 'COC=C(C1CC2N(CC1CC)CCc1c2[nH]c2c1c(OC)ccc2)C(=O)OC' "moclobemide": 'O=C(c1ccc(cc1)Cl)NCCN1CCOCC1' "modafinil": 'NC(=O)CS(=O)C(c1ccccc1)c1ccccc1' "moexipril": 'CCOC(=O)C(NC(C(=O)N1Cc2cc(OC)c(cc2CC1C(=O)O)OC)C)CCc1ccccc1' "moissanite": '[C-]#[Si+]' "mollugin": 'COC(=O)c1c2C=CC(Oc2c2c(c1O)cccc2)(C)C' "moniliformin": 'OC1=CC(=O)C1=O' "monocrotaline": 'O=C1OC2CCN3C2C(=CC3)COC(=O)C(C(C1C)(C)O)(C)O' "monocrotophos": 'CNC(=O)C=C(OP(=O)(OC)OC)C' "monoolein": 'CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O' "monotropein": 'OCC1OC(OC2OC=C(C3C2C(O)(CO)C=C3)C(=O)O)C(C(C1O)O)O' "montmorillonite": 'O=[Si]=O.O=[Si]=O.O=[Si]=O.O=[Si]=O.[O-2].[O-2].[O-2].[Al+3].[Al+3].O' "morin": 'Oc1ccc(c(c1)O)c1oc2cc(O)cc(c2c(=O)c1O)O' "morphin": 'OC1C=CC2C34C1Oc1c4c(CC2N(CC3)C)ccc1O' "morphinan": 'C1CCC23C(C1)C(NCC2)Cc1c3cccc1' "morphine": 'OC1C=CC2C34C1Oc1c4c(CC2N(CC3)C)ccc1O' "moxifloxacin": 'COc1c(N2CC3C(C2)CCCN3)c(F)cc2c1n(cc(c2=O)C(=O)O)C1CC1' "moxonidine": 'COc1nc(C)nc(c1NC1=NCCN1)Cl' "munchiwarin": 'CC(=CCC1=CC(=C(C=Cc2ccc(cc2)O)O)C(=O)C(C1=O)(CC=C(C)C)CC=C(C)C)C' "muscarine": 'OC1CC(OC1C)C[N+](C)(C)C' "muscimol": 'NCc1cc(=O)[nH]o1' "myclobutanil": 'CCCCC(c1ccc(cc1)Cl)(Cn1cncn1)C#N' "mycophenolate": 'COc1c(CC=C(CCC(=O)O)C)c(O)c2c(c1C)COC2=O' "myo-inositol": 'OC1C(O)C(O)C(C(C1O)O)O' "myosmine": 'c1ccc(cn1)C1=NCCC1' "myrcene": 'C=CC(=C)CCC=C(C)C' "myricetin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1cc(O)c(c(c1)O)O' "myricitrin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(C)C(C(C1O)O)O)c1cc(O)c(c(c1)O)O' "myrigalone-G": 'COc1cc(O)c(c(c1C)O)C(=O)CCc1ccccc1' "n-hexane": 'CCCCCC' "n-BuLi": '[Li]CCCC' "n-BuOH": 'CCCCO' "n-Octylboronic Acid": 'CCCCCCCCB(O)O' "n-Octylmagnesium Bromide": 'CCCCCCCC[Mg]Br' "n-Octylp-Toluenesulfonate": 'CCCCCCCCOS(=O)(=O)c1ccc(cc1)C' "n-Octyltrimethylammonium Bromide": 'CCCCCCCC[N+](C)(C)C.[Br-]' "n-Octyltrimethylammonium Chloride": 'CCCCCCCC[N+](C)(C)C.[Cl-]' "nBuLi": '[Li]CCCC' "nabumetone": 'COc1ccc2c(c1)ccc(c2)CCC(=O)C' "naloxonazine": 'C=CCN1CCC23C4(C1Cc1c3c(OC2C(=NN=C2CCC3(C56C2Oc2c6c(CC3N(CC5)CC=C)ccc2O)O)CC4)c(cc1)O)O' "naloxone": 'C=CCN1CCC23C4(C1Cc1c3c(OC2C(=O)CC4)c(cc1)O)O' "naltrexone": 'O=C1CCC2(C34C1Oc1c4c(CC2N(CC3)CC2CC2)ccc1O)O' "naltrindole": 'Oc1ccc2c3c1OC1C43CCN(C(C2)C4(O)Cc2c1[nH]c1c2cccc1)CC1CC1' "nandrolone": 'O=C1CCC2C(=C1)CCC1C2CCC2(C1CCC2O)C' "naphyrone": 'CCCC(C(=O)c1ccc2c(c1)cccc2)N1CCCC1' "naproxen": 'COc1ccc2c(c1)ccc(c2)C(C(=O)O)C' "napy": 'c1cnc2c(c1)cccn2' "narigenin": 'Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2O)O' "naringin": 'OCC1OC(Oc2cc(O)c3c(c2)OC(CC3=O)c2ccc(cc2)O)C(C(C1O)O)OC1OC(C)C(C(C1O)O)O' "narirutin": 'Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O' "nbd": 'C1=CC2CC1C=C2' "nebivolol": 'OC(C1CCc2c(O1)ccc(c2)F)CNCC(C1CCc2c(O1)ccc(c2)F)O' "necrostatin-1": 'S=C1NC(C(=O)N1C)Cc1c[nH]c2c1cccc2' "neocuproine": 'Cc1ccc2c(n1)c1nc(C)ccc1cc2' "neomycin": 'OCC1OC(C(C1OC1OC(CN)C(C(C1N)O)O)O)OC1C(O)C(N)CC(C1OC1OC(CN)C(C(C1N)O)O)N' "neoprotosappanin": 'Oc1ccc2c(c1)OCC1(C2c2cc(O)c(cc2C1c1cc2c(cc1O)OCC1(C2c2cc(O)c(cc2C1)O)O)O)O' "neostigmine": 'O=C(N(C)C)Oc1cccc(c1)[N+](C)(C)C' "nephthoacetal": 'CC(CCC1OC(O)C23C(C1C)CCC3C1C(CC2)C2(C)C=CC(=O)C=C2CC1)C' "netupitant": 'CN1CCN(CC1)c1ncc(c(c1)c1ccccc1C)N(C(=O)C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(C)C)C' "nevirapine": 'O=C1Nc2c(C)ccnc2N(c2c1cccn2)C1CC1' "nia": 'NC(=O)c1cccnc1' "niacin": 'OC(=O)c1cccnc1' "niacinamide": 'NC(=O)c1cccnc1' "nicardipine": 'COC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCCN(Cc1ccccc1)C)C' "nicotinamide": 'NC(=O)c1cccnc1' "nicotine": 'CN1CCCC1c1cccnc1' "nifedipine": 'COC(=O)C1=C(C)NC(=C(C1c1ccccc1[N+](=O)[O-])C(=O)OC)C' "nifurtimox": 'CC1CS(=O)(=O)CCN1N=Cc1ccc(o1)[N+](=O)[O-]' "nilotinib": 'Cc1ncn(c1)c1cc(NC(=O)c2ccc(c(c2)Nc2nccc(n2)c2cccnc2)C)cc(c1)C(F)(F)F' "nimesulide": '[O-][N+](=O)c1ccc(c(c1)Oc1ccccc1)NS(=O)(=O)C' "nimodipine": 'COCCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC(C)C)C' "nisoxetine": 'CNCCC(c1ccccc1)Oc1ccccc1OC' "nitroxoline": '[O-][N+](=O)c1ccc(c2c1cccn2)O' "nmp": 'CN1CCCC1' "nobiletin": 'COc1cc(ccc1OC)c1cc(=O)c2c(o1)c(OC)c(c(c2OC)OC)OC' "nonivamide": 'CCCCCCCCC(=O)NCc1ccc(c(c1)OC)O' "nor-NOHA": 'ONC(=NCCC(C(=O)O)N)N' "nor-binaltorphimine": 'Oc1ccc2c3c1OC1C43CCN(C(C2)C4(O)Cc2c1[nH]c1c2CC2(C34C1Oc1c4c(CC2N(CC3)CC2CC2)ccc1O)O)CC1CC1' "nor-lobelane": 'C1CC(CCc2ccccc2)NC(C1)CCc1ccccc1' "norantipyrine": 'O=C1CC(=NN1c1ccccc1)C' "norbixin": 'CC(=CC=CC=C(C=CC=C(C=CC(=O)O)C)C)C=CC=C(C=CC(=O)O)C' "norbuprenorphine": 'COC12CCC3(CC1C(C(C)(C)C)(O)C)C14C2Oc2c4c(CC3NCC1)ccc2O' "norcamphor": 'O=C1CC2CC1CC2' "norcantharidin": 'O=C1OC(=O)C2C1C1CCC2O1' "norepinephrine": 'NCC(c1ccc(c(c1)O)O)O' "norfloxacin": 'CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCNCC1)c(c2)F' "norflurazon": 'CNc1cnn(c(=O)c1Cl)c1cccc(c1)C(F)(F)F' "norketamine": 'O=C1CCCCC1(N)c1ccccc1Cl' "normetanephrine": 'NCC(c1ccc(c(c1)OC)O)O' "noroxycodone": 'COc1ccc2c3c1OC1C43CCNC(C2)C4(O)CCC1=O' "noroxymorphone": 'O=C1CCC2(C34C1Oc1c4c(CC2NCC3)ccc1O)O' "nortriptyline": 'CNCCC=C1c2ccccc2CCc2c1cccc2' "noviose": 'COC(C(O)(C)C)C(C(C=O)O)O' "nutlin-3": 'COc1ccc(c(c1)OC(C)C)C1=NC(C(N1C(=O)N1CCNC(=O)C1)c1ccc(cc1)Cl)c1ccc(cc1)Cl' "nystose": 'OCC1OC(C(C1O)O)(OCC1(OC2OC(CO)C(C(C2O)O)O)OC(C(C1O)O)CO)COC1(CO)OC(C(C1O)O)CO' "o-Chloramine T": 'Cl[N-]S(=O)(=O)c1ccccc1C.[Na+]' "o-Tolylmagnesium Bromide": 'Br[Mg]c1ccccc1C' "o-anisidine": 'COc1ccccc1N' "o-cresol": 'Cc1ccccc1O' "o-cymene": 'CC(c1ccccc1C)C' "obidoxime": 'O=[NH+]C=C1C=CN(C=C1)COCN1C=CC(=C[NH+]=O)C=C1' "octopamine": 'NCC(c1ccc(cc1)O)O' "oestradiol": 'Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2O)C' "ofloxacin": 'CN1CCN(CC1)c1c(F)cc2c3c1OCC(n3cc(c2=O)C(=O)O)C' "oil-red-O": 'Cc1ccc(c(c1)N=Nc1cc(C)c(cc1C)NN=C1C(=O)C=Cc2c1cccc2)C' "olanzapine": 'CN1CCN(CC1)C1=c2cc(sc2=Nc2c(N1)cccc2)C' "oleamide": 'CCCCCCCCC=CCCCCCCCC(=O)N' "oleanane": 'CC1(C)CCC2(C(C1)C1CCC3C(C1(CC2)C)(C)CCC1C3(C)CCCC1(C)C)C' "oleandrin": 'COC1CC(OC2CCC3(C(C2)CCC2C3CCC3(C2(O)CC(C3C2=CC(=O)OC2)OC(=O)C)C)C)OC(C1O)C' "oleanolic": 'OCC1OC(OC2C(OCC(C2O)O)OC2CCC3(C(C2(C)C)CCC2(C3CC=C3C2(C)CCC2(C3CC(C)(C)CC2)C(=O)O)C)C)C(C(C1O)O)O' "oleocanthal": 'O=CCC(C(=CC)C=O)CC(=O)OCCc1ccc(cc1)O' "oleoyl": 'CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)[O-])O.[Na+]' "olmesartan": 'CCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)C(=O)O)C(O)(C)C' "olodaterol": 'COc1ccc(cc1)CC(NCC(c1cc(O)cc2c1OCC(=O)N2)O)(C)C' "olomoucine": 'OCCNc1nc(NCc2ccccc2)c2c(n1)n(C)cn2' "oltipraz": 'S=c1ssc(c1C)c1cnccn1' "omeprazole": 'COc1ccc2c(c1)[nH]c(n2)S(=O)Cc1ncc(c(c1C)OC)C' "omethoate": 'CNC(=O)CSP(=O)(OC)OC' "ondansetron": 'O=C1C(CCc2c1c1ccccc1n2C)Cn1ccnc1C' "ophioglonin": 'Oc1cc(O)c2c(c1)oc1-c3ccc(c(c3COc1c2=O)O)O' "orcinol": 'Cc1cc(O)cc(c1)O' "oregonin": 'O=C(CC(OC1OCC(C(C1O)O)O)CCc1ccc(c(c1)O)O)CCc1ccc(c(c1)O)O' "orlistat": 'CCCCCCCCCCCC(CC1OC(=O)C1CCCCCC)OC(=O)C(CC(C)C)NC=O' "ornidazole": 'ClCC(Cn1c(C)ncc1[N+](=O)[O-])O' "orthosilicate": '[O-][Si]([O-])([O-])[O-]' "orvepitant": 'Fc1ccc(c(c1)C)C1CC(CCN1C(=O)N(C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)C)N1CCN2C(C1)CCC2=O' "oseltamivir": 'CCOC(=O)C1=CC(C(C(C1)N)NC(=O)C)OC(CC)CC' "ospemifene": 'ClCCC(=C(c1ccccc1)c1ccc(cc1)OCCO)c1ccccc1' "otonecine": 'OCC1=CCN(C)CCC(C1=O)O' "ouabain": 'OCC12C(O)CC(CC2(O)CCC2C1C(O)CC1(C2(O)CCC1C1=CC(=O)OC1)C)OC1OC(C)C(C(C1O)O)O' "oxacillin": 'OC(=O)C1N2C(=O)C(C2SC1(C)C)NC(=O)c1c(C)onc1c1ccccc1' "oxamniquine": 'OCc1cc2CCC(Nc2cc1[N+](=O)[O-])CNC(C)C' "oxazepam": 'O=C1Nc2ccc(cc2C(=NC1O)c1ccccc1)Cl' "oxazepine": 'C1=CC=CC=NO1' "oxotremorine": 'O=C1CCCN1CC#CCN1CCCC1' "oxyacanthine": 'COc1cc2CCN(C3c2cc1Oc1c2c(CCN(C2Cc2ccc(Oc4cc(C3)ccc4O)cc2)C)cc(c1OC)OC)C' "oxycodone": 'COc1ccc2c3c1OC1C43CCN(C(C2)C4(O)CCC1=O)C' "oxyfluorfen": 'CCOc1cc(ccc1[N+](=O)[O-])Oc1ccc(cc1Cl)C(F)(F)F' "oxymatrine": 'O=C1CCCC2N1CC1CCC[N+]3(C1C2CCC3)[O-]' "oxymorphone": 'O=C1CCC2(C34C1Oc1c4c(CC2N(CC3)C)ccc1O)O' "oxyresveratrol": 'Oc1ccc(c(c1)O)C=Cc1cc(O)cc(c1)O' "oxysporone": 'O=C1OC2C(C1)C(O)C=CO2' "oxytocin": 'CCC(C1NC(=O)C(Cc2ccc(cc2)O)NC(=O)C(N)CSSCC(NC(=O)C(NC(=O)C(NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCCC1C(=O)NC(C(=O)NCC(=O)N)CC(C)C)C' "ozone": '[O-][O+]=O' "p-Anisidine": 'COc1ccc(cc1)N' "p-Aom": '[CH2]Oc1ccc(cc1)OC' "p-Cresol": 'Cc1ccc(cc1)O' "p-Cymene": 'Cc1ccc(cc1)C(C)C' "p-HPEA-EDA": 'O=CCC(C(=CC)C=O)CC(=O)OCCc1ccc(cc1)O' "p-Toluenesulfonic Acid Monohydrate": 'Cc1ccc(cc1)S(=O)(=O)O.O' "p-Tolylmagnesium Bromide": 'Br[Mg]c1ccc(cc1)C' "p-TsOH": 'Cc1ccc(cc1)S(=O)(=O)O' "p-aminohippurate": 'O=C(c1ccc(cc1)N)NCC(=O)O' "p-coumarate": 'OC(=O)C=Cc1ccc(cc1)[O-]' "p-cresol": 'Cc1ccc(cc1)O' "p-cymene": 'Cc1ccc(cc1)C(C)C' "pCMBS": 'Cl[Hg]c1ccc(cc1)S(=O)(=O)O' "pHEMA": 'CC(=C)C(=O)OCCO' "pTsOH": 'Cc1ccc(cc1)S(=O)(=O)O' "pTsOH.H2O": 'CC1=CC=C(S(=O)(O)=O)C=C1.HOH' "paeoniflorin": 'OCC1OC(OC23CC4C3(COC(=O)c3ccccc3)C3OC2(C)CC4(O3)O)C(C(C1O)O)O' "paeonol": 'COc1ccc(c(c1)O)C(=O)C' "palbinone": 'O=C1C(=C2C(C1=O)(C)C1(C)CCC3C(C1C=C2)(C)CCC(C3(C)C)O)O' "paliperidone": 'Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2O' "pallidol": 'Oc1cc(O)c2c(c1)C1C(C2c2ccc(cc2)O)c2c(C1c1ccc(cc1)O)c(O)cc(c2)O' "palmatine": 'COc1cc2CC[n+]3c(-c2cc1OC)cc1c(c3)c(OC)c(cc1)OC' "palmitate": 'CCCCCCCCCCCCCCCC(=O)O' "palygorskite": '[Mg].[Mg].[Al].[Al].[Si].[Si].[Si].[Si].[OH-].O.O.O.O.O.O.O.O.O.O.O.O.O.O' "panaxadiol": 'OC1CC2C3(C)CCC(C(C3CCC2(C2(C1C(CC2)C1(C)CCCC(O1)(C)C)C)C)(C)C)O' "pantetheine": 'SCCNC(=O)CCNC(=O)C(C(CO)(C)C)O' "pantoprazole": 'COc1c(OC)ccnc1CS(=O)c1nc2c([nH]1)cc(cc2)OC(F)F' "paracetamol": 'CC(=O)Nc1ccc(cc1)O' "paraoxon": 'CCOP(=O)(Oc1ccc(cc1)[N+](=O)[O-])OCC' "paraquat": 'C[n+]1ccc(cc1)c1cc[n+](cc1)C' "parathion": 'CCOP(=S)(Oc1ccc(cc1)[N+](=O)[O-])OCC' "paraxanthine": 'Cn1cnc2c1c(=O)n(c(=O)[nH]2)C' "paricalcitol": 'OC1CC(O)CC(=CC=C2CCCC3(C2CCC3C(C=CC(C(O)(C)C)C)C)C)C1' "paroxetine": 'Fc1ccc(cc1)C1CCNCC1COc1ccc2c(c1)OCO2' "pasireotide": 'NCCCCC1NC(=O)C(NC(=O)C(NC(=O)C2N(C(=O)C(NC(=O)C(NC1=O)Cc1ccc(cc1)OCc1ccccc1)Cc1ccccc1)CC(C2)OC(=O)NCCN)c1ccccc1)Cc1c[nH]c2c1cccc2' "pazopanib": 'CN(c1ccc2c(c1)nn(c2C)C)c1ccnc(n1)Nc1ccc(c(c1)S(=O)(=O)N)C' "pdt": 'CN(N=Nc1ccccc1)C' "pectolinarigenin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)cc(c(c2O)OC)O' "pedalitin": 'COc1cc2oc(cc(=O)c2c(c1O)O)c1ccc(c(c1)O)O' "peltatoside": 'Oc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(COC2OCC(C(C2O)O)O)C(C(C1O)O)O)c1ccc(c(c1)O)O' "penicillamine": 'NC(C(S)(C)C)C(=O)O' "penoxsulam": 'COc1ncc(c2n1nc(n2)NS(=O)(=O)c1c(cccc1C(F)(F)F)OCC(F)F)OC' "pentagastrin": 'CSCCC(C(=O)NC(C(=O)NC(C(=O)N)Cc1ccccc1)CC(=O)O)NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)CCNC(=O)OC(C)(C)C' "pentamidine": 'NC(=N)c1ccc(cc1)OCCCCCOc1ccc(cc1)C(=N)N' "pentane": 'CCCCC' "pentobarbital": 'CCCC(C1(CC)C(=O)NC(=O)NC1=O)C' "pentosidine": 'NC(C(=O)O)CCCCn1cccc2-c1nc(n2)NCCCC(C(=O)O)N' "pentylenetetrazol": 'C1CCn2c(CC1)nnn2' "pepstatin": 'CC(CC(C(CC(=O)NC(C(=O)NC(C(CC(=O)O)O)CC(C)C)C)O)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)C' "peramivir": 'CCC(C(C1C(N=C(N)N)CC(C1O)C(=O)O)NC(=O)C)CC' "perampanel": 'N#Cc1ccccc1c1cc(cn(c1=O)c1ccccc1)c1ccccn1' "perinaphthenone": 'O=C1C=Cc2c3c1cccc3ccc2' "perlolyrine": 'OCc1ccc(o1)c1nccc2c1[nH]c1c2cccc1' "permethrin": 'ClC(=CC1C(C1(C)C)C(=O)OCc1cccc(c1)Oc1ccccc1)Cl' "perospirone": 'O=C1N(CCCCN2CCN(CC2)c2nsc3c2cccc3)C(=O)C2C1CCCC2' "phaclofen": 'NCC(c1ccc(cc1)Cl)CP(=O)(O)O' "phen": 'c1ccc2c(n1)c1ncccc1cc2' "phenacetin": 'CCOc1ccc(cc1)NC(=O)C' "phencyclidine": 'C1CCC(CC1)(N1CCCCC1)c1ccccc1' "phenformin": 'NC(=NCCc1ccccc1)N=C(N)N' "phenobarbital": 'CCC1(C(=O)NC(=O)NC1=O)c1ccccc1' "phenobarbitone": 'CCC1(C(=O)NC(=O)NC1=O)c1ccccc1' "phenprocoumon": 'CCC(c1c(=O)oc2c(c1O)cccc2)c1ccccc1' "phentolamine": 'Cc1ccc(cc1)N(c1cccc(c1)O)CC1=NCCN1' "phenylbutazone": 'CCCCC1C(=O)N(N(C1=O)c1ccccc1)c1ccccc1' "phenylephrine": 'CNCC(c1cccc(c1)O)O' "phenytoin": 'O=C1NC(=O)NC1(c1ccccc1)c1ccccc1' "phloretin": 'Oc1ccc(cc1)CCC(=O)c1c(O)cc(cc1O)O' "phloridzin": 'OCC1OC(Oc2cc(O)cc(c2C(=O)CCc2ccc(cc2)O)O)C(C(C1O)O)O' "phlorizin": 'OCC1OC(Oc2cc(O)cc(c2C(=O)CCc2ccc(cc2)O)O)C(C(C1O)O)O' "phloroglucinol": 'Oc1cc(O)cc(c1)O' "phorate": 'CCSCSP(=S)(OCC)OCC' "phorbol": 'OCC1=CC2C3C(C3(C)C)(O)C(C(C2(C2C(C1)(O)C(=O)C(=C2)C)O)C)O' "phorone": 'O=C(C=C(C)C)C=C(C)C' "phosgene": 'ClC(=O)Cl' "phth": 'c1ccc2c(n1)c1ncccc1cc2' "phthalazine": 'c1ccc2c(c1)cnnc2' "phthalazinone": 'O=c1[nH]ncc2c1cccc2' "phthalide": 'O=C1OCc2c1cccc2' "phthalimide": 'O=C1NC(=O)c2c1cccc2' "phthalocyanine": 'c1ccc2c(c1)C1=NC2=Nc2[nH]c(c3c2cccc3)N=c2[nH]c(=NC3=NC(=N1)c1ccccc31)c1c2cccc1' "phyllanthin": 'COCC(C(Cc1ccc(c(c1)OC)OC)COC)Cc1ccc(c(c1)OC)OC' "phyllostin": 'COC(=O)C1=CC(C2C(C1)OC(C)C(=O)O2)O' "physcion": 'COc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)C' "physostigmine": 'CNC(=O)Oc1ccc2c(c1)C1(C)CCN(C1N2C)C' "phytate": 'OP(=O)(OC1C(OP(=O)(O)O)C(OP(=O)(O)O)C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)O' "phytoene": 'CC(=CC=CC=C(CCC=C(CCC=C(CCC=C(C)C)C)C)C)CCC=C(CCC=C(CCC=C(C)C)C)C' "phytofluene": 'CC(=CC=CC=C(C=CC=C(CCC=C(CCC=C(C)C)C)C)C)CCC=C(CCC=C(CCC=C(C)C)C)C' "phytosphingosine": 'CCCCCCCCCCCCCCC(C(C(CO)N)O)O' "piceatannol": 'Oc1cc(C=Cc2ccc(c(c2)O)O)cc(c1)O' "piceid": 'OCC1OC(Oc2cc(C=Cc3ccc(cc3)O)cc(c2)O)C(C(C1O)O)O' "picoxystrobin": 'COC=C(c1ccccc1COc1cccc(n1)C(F)(F)F)C(=O)OC' "pilocarpine": 'CCC1C(=O)OCC1Cc1cncn1C' "pimarane": 'CCC1(C)CCC2C(C1)CCC1C2(C)CCCC1(C)C' "pimozide": 'Fc1ccc(cc1)C(c1ccc(cc1)F)CCCN1CCC(CC1)n1c(=O)[nH]c2c1cccc2' "pimprinine": 'Cc1ncc(o1)c1c[nH]c2c1cccc2' "pindolol": 'OC(COc1cccc2c1cc[nH]2)CNC(C)C' "pinocembrin": 'Oc1cc2OC(CC(=O)c2c(c1)O)c1ccccc1' "pinosylvin": 'Oc1cc(C=Cc2ccccc2)cc(c1)O' "pioglitazone": 'CCc1ccc(nc1)CCOc1ccc(cc1)CC1SC(=O)NC1=O' "pip": 'C1CCCNC1' "piperacillin": 'CCN1CCN(C(=O)C1=O)C(=O)NC(C(=O)NC1C(=O)N2C1SC(C2C(=O)O)(C)C)c1ccccc1' "piperaquine": 'Clc1ccc2c(c1)nccc2N1CCN(CC1)CCCN1CCN(CC1)c1ccnc2c1ccc(c2)Cl' "piperine": 'O=C(N1CCCCC1)C=CC=Cc1ccc2c(c1)OCO2' "piperitone": 'CC1=CC(=O)C(CC1)C(C)C' "piplartine": 'COc1cc(C=CC(=O)N2CCC=CC2=O)cc(c1OC)OC' "pirenzepine": 'CN1CCN(CC1)CC(=O)N1c2ccccc2C(=O)Nc2c1nccc2' "pirimicarb": 'CN(C(=O)Oc1nc(nc(c1C)C)N(C)C)C' "piroxicam": 'O=C(C1=C(O)c2ccccc2S(=O)(=O)N1C)Nc1ccccn1' "pitavastatin": 'OC(CC(C=Cc1c(nc2c(c1c1ccc(cc1)F)cccc2)C1CC1)O)CC(=O)O' "pizotifen": 'CN1CCC(=C2c3ccsc3CCc3c2cccc3)CC1' "plastoquinone": 'CC(=CCCC(=CCCC(=CCCC(=CCC1=CC(=O)C(=C(C1=O)C)C)C)C)C)CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(C)C)C)C)C)C' "platyphylloside": 'OCC1OC(OC(CC(=O)CCc2ccc(cc2)O)CCc2ccc(cc2)O)C(C(C1O)O)O' "plitidepsin": 'CCC(C1NC(=O)C(NC(=O)C(N(C(=O)C2CCCN2C(=O)C(=O)C)C)CC(C)C)C(C)OC(=O)C(Cc2ccc(cc2)OC)N(C)C(=O)C2CCCN2C(=O)C(NC(=O)C(C(=O)C(OC(=O)CC1O)C(C)C)C)CC(C)C)C' "plumbagin": 'CC1=CC(=O)c2c(C1=O)cccc2O' "pmdien": 'CN(CCN(C)C)CCN(C)C' "pn": 'NCC(N)C' "podocarpane": 'CC1(C)CCCC2(C1CCC1C2CCCC1)C' "podophyllotoxin": 'COc1cc(cc(c1OC)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)O' "poliothrysoside": 'OCc1cc(O)ccc1OC1OC(COC(=O)c2ccccc2)C(C(C1O)O)O' "polydatin": 'OCC1OC(Oc2cc(C=Cc3ccc(cc3)O)cc(c2)O)C(C(C1O)O)O' "pomalidomide": 'O=C1CCC(C(=O)N1)N1C(=O)c2c(C1=O)c(N)ccc2' "porphobilinogen": 'NCc1[nH]cc(c1CC(=O)O)CCC(=O)O' "porphycene": 'C1=CC2=NC1=CC=c1ccc(=c3ccc(=CC=C4N=C2C=C4)[nH]3)[nH]1' "posaconazole": 'CCC(n1ncn(c1=O)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)OCC1COC(C1)(Cn1cncn1)c1ccc(cc1F)F)C(O)C' "ppt": 'CCCC1=C(c2ccc(cc2)O)N(NC1=C1C=CC(=O)C=C1)c1ccc(cc1)O' "prallethrin": 'C#CCC1=C(C)C(CC1=O)OC(=O)C1C(C1(C)C)C=C(C)C' "pramipexole": 'CCCNC1CCc2c(C1)sc(n2)N' "pranlukast": 'O=C(c1ccc(cc1)OCCCCc1ccccc1)Nc1cccc2c1oc(cc2=O)c1nn[nH]n1' "prasugrel": 'CC(=O)Oc1sc2c(c1)CN(CC2)C(c1ccccc1F)C(=O)C1CC1' "pratensein": 'COc1ccc(cc1O)c1coc2c(c1=O)c(O)cc(c2)O' "pravastatin": 'CCC(C(=O)OC1CC(O)C=C2C1C(CCC(CC(CC(=O)O)O)O)C(C=C2)C)C' "praziquantel": 'O=C(N1CC(=O)N2C(C1)c1ccccc1CC2)C1CCCCC1' "prazosin": 'COc1cc2nc(nc(c2cc1OC)N)N1CCN(CC1)C(=O)c1ccco1' "prednisolone": 'OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)C=CC12C' "prednisone": 'OCC(=O)C1(O)CCC2C1(C)CC(=O)C1C2CCC2=CC(=O)C=CC12C' "pregabalin": 'NCC(CC(=O)O)CC(C)C' "pregnane": 'CCC1CCC2C1(C)CCC1C2CCC2C1(C)CCCC2' "pregnenolone": 'OC1CCC2(C(=CCC3C2CCC2(C3CCC2C(=O)C)C)C1)C' "prilocaine": 'CCCNC(C(=O)Nc1ccccc1C)C' "primaquine": 'NCCCC(Nc1cc(OC)cc2c1nccc2)C' "primidone": 'CCC1(C(=O)NCNC1=O)c1ccccc1' "pristimerin": 'COC(=O)C1(C)CCC2(C(C1)C1(C)CCC3(C(=CC=C4C3=CC(=O)C(=C4C)O)C1(CC2)C)C)C' "proadifen": 'CCCC(c1ccccc1)(c1ccccc1)C(=O)OCCN(CC)CC' "probenecid": 'CCCN(S(=O)(=O)c1ccc(cc1)C(=O)O)CCC' "probucol": 'CC(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C' "prochloraz": 'CCCN(C(=O)n1cncc1)CCOc1c(Cl)cc(cc1Cl)Cl' "procurcumenol": 'CC1=CC(=O)C(=C(C)C)CC2C1CCC2(C)O' "procyclidine": 'OC(c1ccccc1)(C1CCCCC1)CCN1CCCC1' "procymidone": 'O=C1N(c2cc(Cl)cc(c2)Cl)C(=O)C2(C1(C)C2)C' "profenofos": 'CCCSP(=O)(Oc1ccc(cc1Cl)Br)OCC' "progesterone": 'O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2C(=O)C)C)C' "prolinamide": 'NC(=O)C1CCCN1' "prolinate": '[O-]C(=O)C1CCCN1' "promethazine": 'CN(C(CN1c2ccccc2Sc2c1cccc2)C)C' "propafenone": 'CCCNCC(COc1ccccc1C(=O)CCc1ccccc1)O' "propane": 'CCC' "propiconazole": 'CCCC1COC(O1)(Cn1cncn1)c1ccc(cc1Cl)Cl' "propofol": 'CC(c1cccc(c1O)C(C)C)C' "propranolol": 'OC(COc1cccc2c1cccc2)CNC(C)C' "prostacyclin": 'CCCCCC(C=CC1C(O)CC2C1CC(=CCCCC(=O)O)O2)O' "protocatechuate": 'OC(=O)c1ccc(c(c1)O)O' "protopanaxatriol": 'CC(=CCCC(C1CCC2(C1C(O)CC1C2(C)CC(C2C1(C)CCC(C2(C)C)O)O)C)(O)C)C' "prunetin": 'COc1cc(O)c2c(c1)occ(c2=O)c1ccc(cc1)O' "pseudohypericin": 'OCc1cc(O)c2c3c1c1c(C)cc(c4c1c1c3c3c(C2=O)c(O)cc(c3c2c1c(C4=O)c(O)cc2O)O)O' "pseudojujubogenin": 'CC(=CC1COC23C(C1(C)O)C1CCC4C(C1(C3)CO2)(C)CCC1C4(C)CCC(C1(C)C)O)C' "psoralen": 'O=c1ccc2c(o1)cc1c(c2)cco1' "pt": '[Pt]' "pterostilbene": 'COc1cc(C=Cc2ccc(cc2)O)cc(c1)OC' "ptn": 'CC(CC(N)C)N' "puerarin": 'OCC1OC(C(C(C1O)O)O)c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O' "purine": 'c1ncc2c(n1)nc[nH]2' "purmorphamine": 'C1CCC(CC1)n1cnc2c1nc(nc2Nc1ccc(cc1)N1CCOCC1)Oc1cccc2c1cccc2' "puromycin": 'OCC1OC(C(C1NC(=O)C(Cc1ccc(cc1)OC)N)O)n1cnc2c1ncnc2N(C)C' "putrescine": 'NCCCCN' "py": 'c1cccnc1' "pybox": 'C1CN=C(O1)c1cccc(n1)C1=NCCO1' "pyocyanin": 'Cn1c2ccccc2nc2-c1cccc2=O' "pyranocoumarin": 'COC1(C)CC(c2ccccc2)c2c(O1)c1ccccc1oc2=O' "pyridin": 'c1cccnc1' "pyridine": 'c1cccnc1' "pyridostigmine": 'C[n+]1cccc(c1)OC(=O)N(C)C' "pyridoxal": 'O=Cc1c(CO)cnc(c1O)C' "pyridoxine": 'OCc1c(CO)cnc(c1O)C' "pyrimethamine": 'CCc1nc(N)nc(c1c1ccc(cc1)Cl)N' "pyrimidinamine": 'Nc1ncccn1' "pyrocatechol": 'Oc1ccccc1O' "pyrogallol": 'Oc1c(O)cccc1O' "pyrrolysine": 'OC(=O)C(CCCCNC(=O)C1N=CCC1C)N' "pyruvate": 'CC(=O)C(=O)[O-]' "pyz": 'n1ccncc1' "quartz": 'O=[Si]=O' "quercetin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O' "quercetrin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(C)C(C(C1O)O)O)c1ccc(c(c1)O)O' "quercitrin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(C)C(C(C1O)O)O)c1ccc(c(c1)O)O' "quetiapine": 'OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2c1cccc2' "quinacrine": 'CCN(CCCC(Nc1c2cc(OC)ccc2nc2c1ccc(c2)Cl)C)CC' "quinidine": 'C=CC1CN2CCC1CC2C(c1ccnc2c1cc(OC)cc2)O' "quinine": 'C=CC1CN2CCC1CC2C(c1ccnc2c1cc(OC)cc2)O' "quinolinol": 'O=c1ccc2c([nH]1)cccc2' "quinpirole": 'CCCN1CCCC2C1Cc1cn[nH]c1C2' "quinuclidine": 'C1CN2CCC1CC2' "rac-BHFF": 'O=C1Oc2c(C1(O)C(F)(F)F)cc(cc2C(C)(C)C)C(C)(C)C' "racemosol": 'COc1ccc2c(c1O)CCc1c3C2CC(C)(C)Oc3c(c(c1)O)C' "raclopride": 'CCN1CCCC1CNC(=O)c1c(O)c(Cl)cc(c1OC)Cl' "ractopamine": 'CC(NCC(c1ccc(cc1)O)O)CCc1ccc(cc1)O' "raloxifene": 'Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O' "ramiprilat": 'OC(=O)C(NC(C(=O)N1C2CCCC2CC1C(=O)O)C)CCc1ccccc1' "ranolazine": 'COc1ccccc1OCC(CN1CCN(CC1)CC(=O)Nc1c(C)cccc1C)O' "rapamycin": 'COC1CC(CCC1O)CC(C1OC(=O)C2CCCCN2C(=O)C(=O)C2(O)OC(CCC2C)CC(OC)C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)C1)C)C)O)OC)C)C)C)C' "raphasatin": 'CSC=CCCN=C=S' "rasagiline": 'C#CCNC1CCc2c1cccc2' "rebamipide": 'Clc1ccc(cc1)C(=O)NC(C(=O)O)Cc1cc(=O)[nH]c2c1cccc2' "regadenoson": 'OCC1OC(C(C1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC' "remifentanil": 'COC(=O)C1(CCN(CC1)CCC(=O)OC)N(c1ccccc1)C(=O)CC' "repaglinide": 'CCOc1cc(ccc1C(=O)O)CC(=O)NC(c1ccccc1N1CCCCC1)CC(C)C' "resazurin": 'Oc1ccc2c(c1)oc1-c([n+]2[O-])ccc(=O)c1' "reserpine": 'COc1ccc2c(c1)[nH]c1c2CCN2C1CC1C(C2)CC(C(C1C(=O)OC)OC)OC(=O)c1cc(OC)c(c(c1)OC)OC' "resorcinol": 'Oc1cccc(c1)O' "resveratrol": 'Oc1ccc(cc1)C=Cc1cc(O)cc(c1)O' "retigabine": 'CCOC(=O)Nc1ccc(cc1N)NCc1ccc(cc1)F' "retinal": 'O=CC=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C' "retinaldehyde": 'O=CC=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C' "retinol": 'OCC=C(C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C' "retronecine": 'OCC1=CCN2C1C(O)CC2' "reversine": 'C1CCC(CC1)Nc1nc(Nc2ccc(cc2)N2CCOCC2)nc2c1[nH]cn2' "rhamnocitrin": 'COc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(cc1)O' "rhamnose": 'OC1C(C)OC(C(C1O)O)O' "rhein": 'Oc1cc(cc2c1C(=O)c1c(C2=O)cccc1O)C(=O)O' "rhodamine123": 'COC(=O)c1ccccc1c1c2-c(cc(=[NH2+])cc2)oc2c1ccc(c2)N' "ribavirin": 'OCC1OC(C(C1O)O)n1cnc(n1)C(=O)N' "riboflavin": 'OCC(C(C(Cn1c2-c(nc3c1cc(C)c(c3)C)c(=O)[nH]c(=O)n2)O)O)O' "ribofuranose": 'OCC1OC(C(C1O)O)O' "ribose": 'OC1COC(C(C1O)O)O' "ribothymidine": 'OCC1OC(C(C1O)O)n1cc(C)c(=O)[nH]c1=O' "rilpivirine": 'N#CC=Cc1cc(C)c(c(c1)C)Nc1ccnc(n1)Nc1ccc(cc1)C#N' "rimantadine": 'CC(C12CC3CC(C2)CC(C1)C3)N' "rimonabant": 'Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CCCCC1' "risperidone": 'Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2' "ritanserin": 'Fc1ccc(cc1)C(=C1CCN(CC1)CCc1c(C)nc2n(c1=O)ccs2)c1ccc(cc1)F' "ritonavir": 'O=C(NC(C(CC(Cc1ccccc1)NC(=O)C(C(C)C)NC(=O)N(Cc1csc(n1)C(C)C)C)O)Cc1ccccc1)OCc1cncs1' "rivaroxaban": 'O=C1OC(CN1c1ccc(cc1)N1CCOCC1=O)CNC(=O)c1ccc(s1)Cl' "rivastigmine": 'CCN(C(=O)Oc1cccc(c1)C(N(C)C)C)C' "rocaglaol": 'COc1ccc(cc1)C12Oc3c(C2(O)C(CC1c1ccccc1)O)c(OC)cc(c3)OC' "rocuronium": 'C=CC[N+]1(CCCC1)C1CC2C(C1OC(=O)C)(C)CCC1C2CCC2C1(C)CC(C(C2)O)N1CCOCC1' "rofecoxib": 'O=C1OCC(=C1c1ccccc1)c1ccc(cc1)S(=O)(=O)C' "roflumilast": 'FC(Oc1ccc(cc1OCC1CC1)C(=O)Nc1c(Cl)cncc1Cl)F' "romidepsin": 'CC=C1NC(=O)C2CSSCCC=CC(OC(=O)C(NC1=O)C(C)C)CC(=O)NC(C(=O)N2)C(C)C' "ropivacaine": 'CCCN1CCCCC1C(=O)Nc1c(C)cccc1C' "roscovitine": 'CCC(Nc1nc(NCc2ccccc2)c2c(n1)n(cn2)C(C)C)CO' "rosiglitazone": 'O=C1NC(=O)C(S1)Cc1ccc(cc1)OCCN(c1ccccn1)C' "rotenone": 'COc1cc2c(cc1OC)OCC1C2C(=O)c2c(O1)c1CC(Oc1cc2)C(=C)C' "rotigotine": 'CCCN(C1CCc2c(C1)cccc2O)CCc1cccs1' "rottlerin": 'O=C(c1c(O)c(Cc2c(O)c(C)c(c(c2O)C(=O)C)O)c(c2c1OC(C)(C)C=C2)O)C=Cc1ccccc1' "ru": '[Ru]' "rubrene": 'c1ccc(cc1)c1c2ccccc2c(c2c1c(c1ccccc1)c1ccccc1c2c1ccccc1)c1ccccc1' "rufinamide": 'Fc1cccc(c1Cn1nnc(c1)C(=O)N)F' "rutile": 'O=[Ti]=O' "rutin": 'Oc1cc(O)c2c(c1)oc(c(c2=O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O)c1ccc(c(c1)O)O' "ruxolitinib": 'N#CCC(n1ncc(c1)c1ncnc2c1cc[nH]2)C1CCCC1' "sGC": 'OCC1OC(O)C(C(C1S)O)O' "sabinene": 'C=C1CCC2(C1C2)C(C)C' "saccharin": 'O=C1NS(=O)(=O)c2c1cccc2' "saccharose": 'OCC1OC(C(C1O)O)(CO)OC1OC(CO)C(C(C1O)O)O' "safranal": 'O=CC1=C(C)C=CCC1(C)C' "safrole": 'C=CCc1ccc2c(c1)OCO2' "salbutamol": 'OCc1cc(ccc1O)C(CNC(C)(C)C)O' "salicylamide": 'NC(=O)c1ccccc1O' "salicylic": 'OC(=O)c1ccccc1O' "salidroside": 'OCC1OC(OCCc2ccc(cc2)O)C(C(C1O)O)O' "saligenin": 'OCc1ccccc1O' "salmeterol": 'OCc1cc(ccc1O)C(CNCCCCCCOCCCCc1ccccc1)O' "salt": '[Na+].[Cl-]' "salubrinal": 'O=C(NC(C(Cl)(Cl)Cl)NC(=S)Nc1cccc2c1nccc2)C=Cc1ccccc1' "salvigenin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)cc(c(c2O)OC)OC' "sanguinarine": 'C[n+]1cc2c3OCOc3ccc2c2c1c1cc3OCOc3cc1cc2' "santonin": 'CC1C(=O)OC2C1CCC1(C2=C(C)C(=O)C=C1)C' "saquinavir": 'NC(=O)CC(C(=O)NC(C(CN1CC2CCCCC2CC1C(=O)NC(C)(C)C)O)Cc1ccccc1)NC(=O)c1ccc2c(n1)cccc2' "sarafloxacin": 'Fc1ccc(cc1)n1cc(C(=O)O)c(=O)c2c1cc(N1CCNCC1)c(c2)F' "sarcosine": 'CNCC(=O)O' "sarcosyl": 'CCCCCCCCCCCC(=O)N(CC(=O)[O-])C.[Na+]' "sarin": 'CC(OP(=O)(F)C)C' "sarothrin": 'COc1c(O)c(OC)c2c(c1O)c(=O)c(c(o2)c1ccc(cc1)O)OC' "sattabacin": 'OC(C(=O)CC(C)C)Cc1ccccc1' "sciadopitysin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)c(c(cc2O)O)c1cc(ccc1OC)c1cc(=O)c2c(o1)cc(cc2O)OC' "sclareol": 'C=CC(CCC1C(C)(O)CCC2C1(C)CCCC2(C)C)(O)C' "scoparone": 'COc1cc2oc(=O)ccc2cc1OC' "scopine": 'OC1CC2C3C(C(C1)N2C)O3' "scopoletin": 'COc1cc2ccc(=O)oc2cc1O' "scopolin": 'OCC1OC(Oc2cc3oc(=O)ccc3cc2OC)C(C(C1O)O)O' "scutellarein": 'Oc1ccc(cc1)c1cc(=O)c2c(o1)cc(c(c2O)O)O' "scutellarin": 'OC(=O)C1OC(Oc2cc3oc(cc(=O)c3c(c2O)O)c2ccc(cc2)O)C(C(C1O)O)O' "sec-BuLi": 'CCC(C)[Li]' "sec-Butylmagnesium Bromide": 'CC([Mg]Br)CC' "sec-Butylmagnesium Chloride - Lithium Chloride": 'CC([Mg]Cl)CC.[Li+].[Cl-]' "secBuLi": 'CCC(C)[Li]' "secoxyloganin": 'C=CC1C(OC=C(C1CC(=O)O)C(=O)OC)OC1OC(CO)C(C(C1O)O)O' "selenite": '[O-][Se](=O)[O-]' "selenocysteine": 'NC(C(=O)O)C[Se]' "serine": 'OCC(C(=O)O)N' "serotonin": 'NCCc1c[nH]c2c1cc(O)cc2' "serotonine": 'NCCc1c[nH]c2c1cc(O)cc2' "serratin": 'Oc1cc(O)c2c(c1)oc(=O)cc2c1ccccc1' "sertraline": 'CNC1CCC(c2c1cccc2)c1ccc(c(c1)Cl)Cl' "sesamin": 'C1Oc2c(O1)cc(cc2)C1OCC2C1COC2c1ccc2c(c1)OCO2' "sesaminol": 'Oc1cc2OCOc2cc1C1OCC2C1COC2c1ccc2c(c1)OCO2' "sesamol": 'Oc1ccc2c(c1)OCO2' "sesamolinol": 'COc1cc(ccc1O)OC1OCC2C1COC2c1ccc2c(c1)OCO2' "seselin": 'CC1(C)C=Cc2c(O1)ccc1c2oc(=O)cc1' "sevin": 'CNC(=O)Oc1cccc2c1cccc2' "sibutramine": 'CC(CC(C1(CCC1)c1ccc(cc1)Cl)N(C)C)C' "siccayne": 'CC(=C)C#Cc1cc(O)ccc1O' "silatrane": 'C1CN2CCO[Si](O1)OCC2' "silazane": 'C1CCC[Si]C1' "sildenafil": 'CCCc1nn(c2c1[nH]c(nc2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCN(CC1)C)C' "silibinin": 'OCC1Oc2ccc(cc2OC1c1ccc(c(c1)OC)O)C1Oc2cc(O)cc(c2C(=O)C1O)O' "silica": 'O=[Si]=O' "silybin": 'OCC1Oc2ccc(cc2OC1c1ccc(c(c1)OC)O)C1Oc2cc(O)cc(c2C(=O)C1O)O' "silychristin": 'OCC1c2cc(cc(c2OC1c1ccc(c(c1)OC)O)O)C1Oc2cc(O)cc(c2C(=O)C1O)O' "simvastatin": 'CCC(C(=O)OC1CC(C)C=C2C1C(CCC1CC(O)CC(=O)O1)C(C=C2)C)(C)C' "sinapaldehyde": 'COc1cc(C=CC=O)cc(c1O)OC' "sinensetin": 'COc1ccc(cc1OC)c1cc(=O)c2c(o1)cc(c(c2OC)OC)OC' "sirolimus": 'COC1CC(CCC1O)CC(C1OC(=O)C2CCCCN2C(=O)C(=O)C2(O)OC(CCC2C)CC(OC)C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)C1)C)C)O)OC)C)C)C)C' "sirtinol": 'O=C(c1ccccc1NC=C1C(=O)C=Cc2c1cccc2)NC(c1ccccc1)C' "sitagliptin": 'NC(Cc1cc(F)c(cc1F)F)CC(=O)N1CCn2c(C1)nnc2C(F)(F)F' "sitosterol": 'CCC(C(C)C)CCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O)C' "sivelestat": 'OC(=O)CNC(=O)c1ccccc1NS(=O)(=O)c1ccc(cc1)OC(=O)C(C)(C)C' "soman": 'CC(C(C)(C)C)OP(=O)(F)C' "sophocarpine": 'O=C1C=CCC2N1CC1CCCN3C1C2CCC3' "sophoridine": 'O=C1CCCC2N1CC1CCCN3C1C2CCC3' "sorafenib": 'CNC(=O)c1nccc(c1)Oc1ccc(cc1)NC(=O)Nc1ccc(c(c1)C(F)(F)F)Cl' "sorbate": 'CC=CC=CC(=O)[O-]' "sorbitol": 'OCC(C(C(C(CO)O)O)O)O' "span60": 'CCCCCCCCCCCCCCCCCC(=O)OCC(C1OCC(C1O)O)O' "span80": 'CCCCCCCCC=CCCCCCCCC(=O)OCC(C1OCC(C1O)O)O' "speciophylline": 'COC(=O)C1=COC(C2C1CC1N(C2)CCC21C(=O)Nc1c2cccc1)C' "spermidine": 'NCCCNCCCCN' "spermine": 'NCCCNCCCCNCCCN' "sphingosine": 'CCCCCCCCCCCCCC=CC(C(CO)N)O' "spironolactone": 'CC(=O)SC1CC2=CC(=O)CCC2(C2C1C1CCC3(C1(CC2)C)CCC(=O)O3)C' "spirostan": 'CC1CCC2(OC1)OC1C(C2C)C2(C(C1)C1CCC3C(C1CC2)(C)CCCC3)C' "squalane": 'CC(CCCC(CCCC(C)C)C)CCCCC(CCCC(CCCC(C)C)C)C' "squalene": 'CC(=CCCC=C(CCC=C(CCC=C(C)C)C)C)CCC=C(CCC=C(C)C)C' "stachydrine": '[O-]C(=O)C1CCC[N+]1(C)C' "stearin": 'CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC' "stearoyl-CoA": 'CCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(COP(=O)(OP(=O)(OCC1OC(C(C1OP(=O)(O)O)O)n1cnc2c1ncnc2N)O)O)(C)C)O' "stien": 'N/C(=C(\c1ccccc1)/N)/c1ccccc1' "stigmasterol": 'CCC(C(C)C)C=CC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O)C' "stilbene": 'c1ccc(cc1)C=Cc1ccccc1' "stiripentol": 'OC(C(C)(C)C)C=Cc1ccc2c(c1)OCO2' "streptavidin": 'OC(=O)CSC(=[N+]1CCCCC1)c1cccc(c1)Cl.[Br-]' "streptozocin": 'OCC1OC(O)C(C(C1O)O)NC(=O)N(N=O)C' "strychnine": 'O=C1CC2OCC=C3C4C2C2N1c1ccccc1C12CCN(C1C4)C3' "styrene": 'C=Cc1ccccc1' "styrene-isoprene-styrene": 'C=Cc1ccccc1.C=Cc1ccccc1.C=CC(=C)C' "sucralose": 'ClCC1OC(C(C1O)O)(CCl)OC1OC(CO)C(C(C1O)O)Cl' "sucrose": 'OCC1OC(C(C1O)O)(CO)OC1OC(CO)C(C(C1O)O)O' "sulfadimethoxine": 'COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)N' "sulfadoxine": 'COc1c(OC)ncnc1NS(=O)(=O)c1ccc(cc1)N' "sulfanegen": 'OC(=O)C1(O)SCC(SC1)(O)C(=O)O' "sulfaphenazole": 'Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1c1ccccc1' "sulforaphane": 'S=C=NCCCCS(=O)C' "sulforaphene": 'CS(=O)C=CCCN=C=S' "sulphadiazine": 'Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1' "sulphanilamide": 'Nc1ccc(cc1)S(=O)(=O)N' "sulpiride": 'CCN1CCCC1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N' "sulthiame": 'O=S1(=O)CCCCN1c1ccc(cc1)S(=O)(=O)N' "sumanene": 'c1cc2Cc3c4c2c2c1Cc1c2c2c4c(cc3)Cc2cc1' "sumatriptan": 'CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2' "sunitinib": 'CCN(CCNC(=O)c1c(C)[nH]c(c1C)C=C1C(=O)Nc2c1cc(F)cc2)CC' "superhydride": 'CC[B-](CC)CC.[Li+]' "superoxide": '[O-][O]' "suramin": 'O=C(Nc1cccc(c1)C(=O)Nc1cc(ccc1C)C(=O)Nc1ccc(c2c1c(cc(c2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)Nc1cccc(c1)C(=O)Nc1cc(ccc1C)C(=O)Nc1ccc(c2c1c(cc(c2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O' "surinamensin": 'CC=Cc1ccc(c(c1)OC)OC(C(c1cc(OC)c(c(c1)OC)OC)O)C' "suvorexant": 'Cc1ccc(c(c1)C(=O)N1CCN(CCC1C)c1oc2c(n1)cc(cc2)Cl)n1nccn1' "sweroside": 'C=CC1C(OC=C2C1CCOC2=O)OC1OC(CO)C(C(C1O)O)O' "swertiamarin": 'C=CC1C(OC=C2C1(O)CCOC2=O)OC1OC(CO)C(C(C1O)O)O' "syringaldehyde": 'COc1cc(C=O)cc(c1O)OC' "syringetin": 'COc1cc(cc(c1O)OC)c1oc2cc(O)cc(c2c(=O)c1O)O' "syringol": 'COc1cccc(c1O)OC' "t-BME": 'COC(C)(C)C' "t-BuLi": '[Li]C(C)(C)C' "t-BuOH": 'CC(O)(C)C' "t-BuOK": '[O-]C(C)(C)C.[K+]' "tBHP": 'OOC(C)(C)C' "tBHQ": 'Oc1ccc(c(c1)C(C)(C)C)O' "tBME": 'COC(C)(C)C' "tBuBHQ": 'CC(c1cc(O)c(cc1O)C(C)(C)C)(C)C' "tBuLi": '[Li]C(C)(C)C' "tBuOK": '[O-]C(C)(C)C.[K+]' "tabun": 'CCOP(=O)(N(C)C)C#N' "tacn": 'N1CCNCCNCC1' "tacrine": 'Nc1c2CCCCc2nc2c1cccc2' "tadalafil": 'O=C1N(C)CC(=O)N2C1Cc1c(C2c2ccc3c(c2)OCO3)[nH]c2c1cccc2' "taleranol": 'OC1CCCCCc2cc(O)cc(c2C(=O)OC(CCC1)C)O' "tamarixetin": 'COc1ccc(cc1O)c1oc2cc(O)cc(c2c(=O)c1O)O' "tamoxifen": 'CCC(=C(c1ccccc1)c1ccc(cc1)OCCN(C)C)c1ccccc1' "tandutinib": 'COc1cc2c(cc1OCCCN1CCCCC1)ncnc2N1CCN(CC1)C(=O)Nc1ccc(cc1)OC(C)C' "tangeretin": 'COc1ccc(cc1)c1cc(=O)c2c(o1)c(OC)c(c(c2OC)OC)OC' "tap": 'NCC(CN)N' "tariquidar": 'COc1cc(C(=O)Nc2ccc(cc2)CCN2CCc3c(C2)cc(c(c3)OC)OC)c(cc1OC)NC(=O)c1cnc2c(c1)cccc2' "tartrazine": '[O-]C(=O)C1=NN(C(=O)C1N=Nc1ccc(cc1)S(=O)(=O)[O-])c1ccc(cc1)S(=O)(=O)[O-].[Na+].[Na+].[Na+]' "tasocitinib": 'N#CCC(=O)N1CCC(C(C1)N(c1ncnc2c1cc[nH]2)C)C' "taurine": 'NCCS(=O)(=O)O' "taurocholate": 'OC1CCC2(C(C1)CC(C1C2CC(O)C2(C1CCC2C(CCC(=O)NCCS(=O)(=O)O)C)C)O)C' "taxifolin": 'Oc1cc2OC(c3ccc(c(c3)O)O)C(C(=O)c2c(c1)O)O' "taxol": 'CC(=O)OC1C(=O)C2(C)C(O)CC3C(C2C(C2(C(C1=C(C)C(OC(=O)C(C(c1ccccc1)NC(=O)c1ccccc1)O)C2)(C)C)O)OC(=O)c1ccccc1)(CO3)OC(=O)C' "tazobactam": 'OC(=O)C1N2C(=O)CC2S(=O)(=O)C1(C)Cn1ccnn1' "tcc-CDT": 'C1CCC/C=C\C=C\C=C/CC1' "tcne": 'N#CC(=C(C#N)C#N)C#N' "tcnq": 'N#CC(=c1ccc(=C(C#N)C#N)cc1)C#N' "tebuconazole": 'Clc1ccc(cc1)CCC(C(C)(C)C)(Cn1cncn1)O' "tecadenoson": 'OCC1OC(C(C1O)O)n1cnc2c1ncnc2NC1COCC1' "telaprevir": 'CCCC(C(=O)C(=O)NC1CC1)NC(=O)C1C2CCCC2CN1C(=O)C(C(C)(C)C)NC(=O)C(C1CCCCC1)NC(=O)c1nccnc1' "tellurite": '[O-][Te](=O)[O-]' "telmisartan": 'CCCc1nc2c(n1Cc1ccc(cc1)c1ccccc1C(=O)O)cc(cc2C)c1nc2c(n1C)cccc2' "temoporfin": 'Oc1cccc(c1)C1=C2CCC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1cccc(c1)O)C=C3)c1cccc(c1)O)[nH]2)c1cccc(c1)O' "tempol": 'OC1CC(C)(C)N(C(C1)(C)C)[O]' "tenofovir": 'CC(Cn1cnc2c1ncnc2N)OCP(=O)(O)O' "tenoxicam": 'O=C(C1=C(O)c2sccc2S(=O)(=O)N1C)Nc1ccccn1' "tentoxin": 'CC(CC1NC(=O)C(C)N(C)C(=O)CNC(=O)C(=Cc2ccccc2)N(C1=O)C)C' "terbinafine": 'CN(Cc1cccc2c1cccc2)CC=CC#CC(C)(C)C' "terbuthylazine": 'CCNc1nc(Cl)nc(n1)NC(C)(C)C' "terbutryn": 'CCNc1nc(SC)nc(n1)NC(C)(C)C' "terfenadine": 'OC(c1ccc(cc1)C(C)(C)C)CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O' "teriflunomide": 'N#CC(=C(O)C)C(=O)Nc1ccc(cc1)C(F)(F)F' "terpineol": 'CC1=CCC(CC1)C(O)(C)C' "terpy": 'c1ccc(nc1)c1ncccc1c1ccccn1' "tert-BuLi": '[Li]C(C)(C)C' "tert-BuLi,": '[Li]C(C)(C)C' "tert-Butyl Hydroperoxide": 'OOC(C)(C)C' "tert-Butyldimethylsilane": 'C[SiH](C(C)(C)C)C' "tert-Butyldimethylsilanol": 'C[Si](C(C)(C)C)(O)C' "tert-Butyldiphenylsilane": 'CC([SiH](c1ccccc1)c1ccccc1)(C)C' "tert-Butylmagnesium Chloride": 'Cl[Mg]C(C)(C)C' "tert-Butylmethoxyphenylsilyl Bromide": 'CO[Si](C(C)(C)C)(c1ccccc1)Br' "tertBuli": '[Li]C(C)(C)C' "testosterone": 'O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2O)C)C' "tetracaine": 'CCCCNc1ccc(cc1)C(=O)OCCN(C)C' "tetraglycine": 'NCC(=O)NCC(=O)NCC(=O)NCC(=O)O' "tetraglyme": 'COCCOCCOCCOCCOC' "tetralone": 'O=C1CCCc2c1cccc2' "tetramethrin": 'O=C(C1C(C1(C)C)C=C(C)C)OCN1C(=O)C2=C(C1=O)CCCC2' "tetren": 'NCCNCCNCCNCCN' "tfp": 'c1coc(c1)P(c1ccco1)c1ccco1' "thalidomide": 'O=C1CCC(C(=O)N1)N1C(=O)c2c(C1=O)cccc2' "thapsigargin": 'CCCCCCCC(=O)OC1C(OC(=O)C(=CC)C)C(=C2C1C(C)(OC(=O)C)CC(C1(C2OC(=O)C1(C)O)O)OC(=O)CCC)C' "theaflavin": 'Oc1cc2OC(C(Cc2c(c1)O)O)c1cc(=O)c(c2c(c1)c(cc(c2O)O)C1Oc2cc(O)cc(c2CC1O)O)O' "theobromine": 'Cn1cnc2c1c(=O)[nH]c(=O)n2C' "theophylline": 'Cn1c(=O)n(C)c2c(c1=O)[nH]cn2' "thiabendazole": 'c1scc(n1)c1nc2c([nH]1)cccc2' "thiamphenicol": 'OCC(C(c1ccc(cc1)S(=O)(=O)C)O)NC(=O)C(Cl)Cl' "thienorphine": 'COC12CCC3(CC1C(CCc1cccs1)(O)C)C14C2Oc2c4c(CC3N(CC1)CC1CC1)ccc2O' "thionine": 'Nc1ccc2c(c1)sc1-c(n2)ccc(=[NH2+])c1.[Cl-]' "thiopurine": 'S=c1nc[nH]c2c1[nH]cn2' "thiorphan": 'SCC(C(=O)NCC(=O)O)Cc1ccccc1' "thiox": 'C1CCOSC1' "thiram": 'CN(C(=S)SSC(=S)N(C)C)C' "threonine": 'CC(C(C(=O)O)N)O' "tht": 'C1CCCS1' "thy": 'Cc1c[nH]c(=O)[nH]c1=O' "thymidine": 'OCC1OC(CC1O)n1cc(C)c(=O)[nH]c1=O' "thymine": 'Cc1c[nH]c(=O)[nH]c1=O' "thymol": 'Cc1ccc(c(c1)O)C(C)C' "thymoquinone": 'CC(C1=CC(=O)C(=CC1=O)C)C' "thyroxin": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "thyroxine": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)N' "tiagabine": 'OC(=O)C1CCCN(C1)CCC=C(c1sccc1C)c1sccc1C' "tiapride": 'CCN(CCNC(=O)c1cc(ccc1OC)S(=O)(=O)C)CC' "ticagrelor": 'CCCSc1nc(NC2CC2c2ccc(c(c2)F)F)c2c(n1)n(nn2)C1CC(C(C1O)O)OCCO' "ticlopidine": 'Clc1ccccc1CN1CCc2c(C1)ccs2' "tigecycline": 'O=C(Nc1cc(N(C)C)c2c(c1O)C(=C1C(C2)CC2C(C1=O)(O)C(=C(C(=O)C2N(C)C)C(=O)N)O)O)CNC(C)(C)C' "tigliane": 'CC1CC2CC(CC2C2C(C1)C1C(C1(C)C)CC2C)C' "timolol": 'OC(COc1nsnc1N1CCOCC1)CNC(C)(C)C' "tinidazole": 'CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-]' "tiotropium": 'O=C(C(c1cccs1)(c1cccs1)O)OC1CC2C3C(C(C1)[N+]2(C)C)O3' "tirilazad": 'O=C1C=CC2(C(=C1)CCC1C2=CCC2(C1CC(C2C(=O)CN1CCN(CC1)c1cc(nc(n1)N1CCCC1)N1CCCC1)C)C)C' "tirucallane": 'CC(CCCC(C1CCC2(C1(C)CCC1C2CCC2C1(C)CCCC2(C)C)C)C)C' "titania": 'O=[Ti]=O' "tivozanib": 'COc1cc2c(ccnc2cc1OC)Oc1ccc(c(c1)Cl)NC(=O)Nc1noc(c1)C' "tmeda": 'CN(CCN(C)C)C' "tmen": 'CN(CCN(C)C)C' "tn": 'NCCCN' "tobermorite": '[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[H+].[H+].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].O.O.O.O' "tobramycine": 'NCC1OC(OC2C(N)CC(C(C2O)OC2OC(CO)C(C(C2O)N)O)N)C(CC1O)N' "tofacitinib": 'N#CCC(=O)N1CCC(C(C1)N(c1ncnc2c1cc[nH]2)C)C' "tolbutamide": 'CCCCNC(=O)NS(=O)(=O)c1ccc(cc1)C' "tolrestat": 'COc1ccc2c(c1C(F)(F)F)cccc2C(=S)N(CC(=O)O)C' "toluene": 'Cc1ccccc1' "toluquinol": 'Oc1ccc(c(c1)C)O' "tolylfluanid": 'Cc1ccc(cc1)N(S(=O)(=O)N(C)C)SC(Cl)(Cl)F' "tomatidine": 'CC1CCC2(NC1)OC1C(C2C)C2(C(C1)C1CCC3C(C1CC2)(C)CCC(C3)O)C' "topiramate": 'NS(=O)(=O)OCC12OCC3C(C2OC(O1)(C)C)OC(O3)(C)C' "topotecan": 'CCC1(O)C(=O)OCc2c1cc1-c3nc4ccc(c(c4cc3Cn1c2=O)CN(C)C)O' "torsemide": 'CC(NC(=O)NS(=O)(=O)c1cnccc1Nc1cccc(c1)C)C' "tosyl": 'OC(C(Cl)(Cl)Cl)O' "tosylate": 'Cc1ccc(cc1)S(=O)(=O)[O-]' "totarol": 'CC(c1c(O)ccc2c1CCC1C2(C)CCCC1(C)C)C' "tramadol": 'COc1cccc(c1)C1(O)CCCCC1CN(C)C' "trans,trans-1,5-Bis(4-fluorophenyl)-1,4-pentadien-3-one": 'O=C(/C=C/c1ccc(cc1)F)/C=C/c1ccc(cc1)F' "trans,trans-1,5-Bis(4-methoxyphenyl)-1,4-pentadien-3-one": 'COc1ccc(cc1)/C=C/C(=O)/C=C/c1ccc(cc1)OC' "trans,trans-1,5-Bis[4-(trifluoromethyl)phenyl]-1,4-pentadien-3-one": 'O=C(/C=C/c1ccc(cc1)C(F)(F)F)/C=C/c1ccc(cc1)C(F)(F)F' "trans,trans-1,5-Diphenyl-1,4-pentadien-3-one": 'O=C(/C=C/c1ccccc1)/C=C/c1ccccc1' "trans-1,2-Bis(diphenylphosphino)ethylene": 'c1ccc(cc1)P(c1ccccc1)/C=C/P(c1ccccc1)c1ccccc1' "trans-2,6-Diisopropyl-N-(2-pyridylmethylene)aniline": 'CC(c1cccc(c1/N=C/c1ccccn1)C(C)C)C' "trans-2-Butene-1,4-bis(triphenylphosphonium Chloride)": 'C(=C\C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)/C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-].[Cl-]' "trans-4-(tert-Butyldiphenylsilyloxy)-L-proline": 'OC(=O)[C@H]1NC[C@@H](C1)O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1' "trans-4-Fluoro-L-proline": 'OC(=O)[C@@H]1C[C@H](CN1)F' "trans-anethole": 'CC=Cc1ccc(cc1)OC' "trans-ferulate": 'COc1cc(C=CC(=O)O)ccc1O' "trans-hinokiresinol": 'C=CC(c1ccc(cc1)O)C=Cc1ccc(cc1)O' "trans-isoeugenol": 'CC=Cc1ccc(c(c1)OC)O' "trans-resveratrol": 'Oc1ccc(cc1)C=Cc1cc(O)cc(c1)O' "trans-stilbene": 'c1ccc(cc1)C=Cc1ccccc1' "trans-totarol": 'CC(c1c(O)ccc2c1CCC1C2(C)CCCC1(C)C)C' "trehalose": 'OCC1OC(OC2OC(CO)C(C(C2O)O)O)C(C(C1O)O)O' "tren": 'NCCN(CCN)CCN' "trenbolone": 'O=C1CCC2=C3C=CC4(C(C3CCC2=C1)CCC4O)C' "triacetine": 'CC(=O)OC(COC(=O)C)COC(=O)C' "triacontanol": 'CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO' "triadimefon": 'O=C(C(C)(C)C)C(n1ncnc1)Oc1ccc(cc1)Cl' "triadimenol": 'OC(C(C)(C)C)C(n1ncnc1)Oc1ccc(cc1)Cl' "triamcinolone": 'OCC(=O)C1(O)C(O)CC2C1(C)CC(O)C1(C2CCC2=CC(=O)C=CC12C)F' "triazolam": 'Clc1ccc2-n3c(CN=C(c2c1)c1ccccc1Cl)nnc3C' "tricetin": 'Oc1cc(O)c2c(c1)oc(cc2=O)c1cc(O)c(c(c1)O)O' "trichostatin": 'ONC(=O)C=CC(=CC(C(=O)c1ccc(cc1)N(C)C)C)C' "tricin": 'COc1cc(cc(c1O)OC)c1cc(=O)c2c(o1)cc(cc2O)O' "tricine": 'OCC(NCC(=O)O)(CO)CO' "triclosan": 'Clc1ccc(c(c1)O)Oc1ccc(cc1Cl)Cl' "trien": 'NCCNCCNCCN' "trifluoperazine": 'CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F' "trigonelline": 'C[n+]1cccc(c1)C(=O)[O-]' "triiodothyronine": 'OC(=O)C(Cc1cc(I)c(c(c1)I)Oc1ccc(c(c1)I)O)N' "trimethoprim": 'COc1cc(Cc2cnc(nc2N)N)cc(c1OC)OC' "trimipramine": 'CN(CC(CN1c2ccccc2CCc2c1cccc2)C)C' "triolein": 'CCCCCCCCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC' "triparanol": 'CCN(CCOc1ccc(cc1)C(c1ccc(cc1)C)(Cc1ccc(cc1)Cl)O)CC' "triphos": 'c1ccc(cc1)P(CCP(c1ccccc1)c1ccccc1)CCP(c1ccccc1)c1ccccc1' "triptolide": 'O=C1OCC2=C1CCC1(C2CC2C3(C41OC4C1OC1(C3O)C(C)C)O2)C' "triptorelin": 'OCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1CCCC1C(=O)NCC(=O)N)CCCN=C(N)N)CC(C)C)Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O)NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C1CCC(=O)N1)Cc1[nH]cnc1' "tris": 'OCC(CO)(CO)N' "troglitazone": 'O=C1NC(=O)C(S1)Cc1ccc(cc1)OCC1(C)CCc2c(O1)c(C)c(c(c2C)O)C' "trolox": 'Cc1c2OC(C)(CCc2c(c(c1C)O)C)C(=O)O' "tropane": 'CN1C2CCCC1CC2' "trovafloxacin": 'NC1C2C1CN(C2)c1nc2c(cc1F)c(=O)c(cn2c1ccc(cc1F)F)C(=O)O' "trpn": 'NCCCN(CCCN)CCCN' "trypsin": 'CC(=O)O.OCC(C(=O)NC(C(=O)Nc1cc(C)c2c(c1)oc(=O)cc2)CCCN=C(N)N)NC(=O)C(Cc1ccccc1)NC(=O)OC(C)(C)C' "tryptamine": 'NCCc1c[nH]c2c1cccc2' "tryptanthrin": 'O=C1c2nc3ccccc3c(=O)n2-c2c1cccc2' "tryptophan": 'OC(=O)C(Cc1c[nH]c2c1cccc2)N' "tryptophane": 'OC(=O)C(Cc1c[nH]c2c1cccc2)N' "ttc-CDT": 'C1CCC/C=C\C=C\C=C/CC1' "ttt-CDT": 'C1CCC/C=C\C=C\C=C/CC1' "tu": 'NC(=S)N' "turinabol": 'CC(=O)OC1CCC2C1(C)CCC1C2CCC2=C(C(=O)CCC12C)Cl' "typharin": 'O=C1OC(C=Cc2ccccc2)Cc2c1c(O)ccc2' "tyramine": 'NCCc1ccc(cc1)O' "tyroscherin": 'CCC(CC(C=CCCC(C(Cc1ccc(cc1)O)NC)O)C)C' "tyrosine": 'OC(=O)C(Cc1ccc(cc1)O)N' "tyrosol": 'OCCc1ccc(cc1)O' "tz": 'c1nccs1' "umbelliferone": 'Oc1ccc2c(c1)oc(=O)cc2' "ura": 'O=c1cc[nH]c(=O)[nH]1' "uracil": 'O=c1cc[nH]c(=O)[nH]1' "urantide": 'NCCCC1NC(=O)C(NC(=O)C(Cc2ccccc2)NC(=O)C(NC(=O)C(CC(=O)O)N)C(SSCC(NC(=O)C(NC1=O)Cc1ccc(cc1)O)C(=O)NC(C(=O)O)C(C)C)(C)C)Cc1c[nH]c2c1cccc2' "urea": 'NC(=O)N' "urethane": 'CCOC(=O)N' "uridine": 'OCC1OC(C(C1O)O)n1ccc(=O)[nH]c1=O' "ursane": 'CC1CCC2(C(C1C)C1CCC3C(C1(CC2)C)(C)CCC1C3(C)CCCC1(C)C)C' "uvaol": 'OCC12CCC(C(C2C2=CCC3C(C2(CC1)C)(C)CCC1C3(C)CCC(C1(C)C)O)C)C' "valacyclovir": 'CC(C(C(=O)OCCOCn1cnc2c1[nH]c(N)nc2=O)N)C' "valdecoxib": 'Cc1onc(c1c1ccc(cc1)S(=O)(=O)N)c1ccccc1' "valganciclovir": 'OCC(OCn1cnc2c1[nH]c(N)nc2=O)COC(=O)C(C(C)C)N' "valine": 'NC(C(=O)O)C(C)C' "valsartan": 'CCCCC(=O)N(C(C(=O)O)C(C)C)Cc1ccc(cc1)c1ccccc1c1n[nH]nn1' "vancomycin": 'OCC1OC(Oc2c3cc4cc2Oc2ccc(cc2Cl)C(O)C2NC(=O)C(NC(=O)C4NC(=O)C(CC(=O)N)NC(=O)C(C(c4ccc(O3)c(Cl)c4)O)NC(=O)C(CC(C)C)NC)c3ccc(c(-c4c(O)cc(cc4C(NC2=O)C(=O)O)O)c3)O)C(C(C1O)O)OC1OC(C)C(C(C1)(C)N)O' "vandetanib": 'COc1cc2c(ncnc2cc1OCC1CCN(CC1)C)Nc1ccc(cc1F)Br' "vanillin": 'COc1cc(C=O)ccc1O' "vardenafil": 'CCOc1ccc(cc1c1nc(=O)c2n([nH]1)c(CCC)nc2C)S(=O)(=O)N1CCN(CC1)CC' "vegfrecine": 'NC(=O)C1=C(N)C(=O)C=C(C1=O)Nc1ccccc1O' "vemurafenib": 'CCCS(=O)(=O)Nc1ccc(c(c1F)C(=O)c1c[nH]c2c1cc(cn2)c1ccc(cc1)Cl)F' "venenatine": 'COC(=O)C1C(O)CCC2C1CC1N(C2)CCc2c1[nH]c1c2c(OC)ccc1' "venlafaxine": 'COc1ccc(cc1)C(C1(O)CCCCC1)CN(C)C' "verapamil": 'COc1ccc(cc1OC)CCN(CCCC(c1ccc(c(c1)OC)OC)(C(C)C)C#N)C' "verbascoside": 'OCC1OC(OCCc2ccc(c(c2)O)O)C(C(C1OC(=O)C=Cc1ccc(c(c1)O)O)OC1OC(C)C(C(C1O)O)O)O' "vesnarinone": 'COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc2c(c1)CCC(=O)N2' "vigabatrin": 'NC(C=C)CCC(=O)O' "vilanterol": 'OCc1cc(ccc1O)C(CNCCCCCCOCCOCc1c(Cl)cccc1Cl)O' "vincamine": 'COC(=O)C1(O)CC2(CC)CCCN3C2c2n1c1ccccc1c2CC3' "vinclozolin": 'C=CC1(C)OC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl' "vinfos": 'Cl/C=C(\c1cc(Cl)c(cc1Cl)Cl)/OP(=O)(OC)OC' "vinyl bromide": 'BrC=C' "vinyl chloride": 'ICC=C' "vinyl iodide": 'IC=C' "violaxanthin": 'CC(=CC=CC=C(C=CC=C(C=CC12OC2(C)CC(CC1(C)C)O)C)C)C=CC=C(C=CC12OC2(C)CC(CC1(C)C)O)C' "viridiflorene": 'CC1CCC2=C(C)CCC3C(C12)C3(C)C' "virodhamine": 'CCCCCC=CCC=CCC=CCC=CCCCC(=O)OCCN' "virolin": 'CC=Cc1ccc(c(c1)OC)OC(C(c1ccc(c(c1)OC)OC)O)C' "visanol": 'OCC=Cc1cc(O)c2c(c1)c(CO)c(o2)c1ccc(c(c1)OC)O' "vismodegib": 'O=C(c1ccc(cc1Cl)S(=O)(=O)C)Nc1ccc(c(c1)c1ccccn1)Cl' "vitexin": 'OCC1OC(C(C(C1O)O)O)c1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O' "vizantin": 'CCCCCCCCCC(CC(=O)OCC1OC(OC2OC(COC(=O)CC(CCCCCCCCC)CCCCCCCCC)C(C(C2O)O)O)C(C(C1O)O)O)CCCCCCCCC' "volinanserin": 'COc1cccc(c1OC)C(C1CCN(CC1)CCc1ccc(cc1)F)O' "voriconazole": 'Fc1ccc(c(c1)F)C(C(c1ncncc1F)C)(Cn1cncn1)O' "vorinostat": 'ONC(=O)CCCCCCC(=O)Nc1ccccc1' "warfarin": 'CC(=O)CC(c1c(=O)oc2c(c1O)cccc2)c1ccccc1' "withawrightolide": 'O=C1OC2CC(C1=C)(C)OCC2C1CCC2C1(C)CCC1C2CC(C23C1(C)C(=O)CC3C2)O' "wogonin": 'COc1c(O)cc(c2c1oc(cc2=O)c1ccccc1)O' "wortmannin": 'COCC1OC(=O)c2c3C1(C)C1=C(C(=O)c3oc2)C2C(CC1OC(=O)C)(C)C(=O)CC2' "xanthine": 'O=c1[nH]c(=O)c2c([nH]1)nc[nH]2' "xanthohumol": 'COc1cc(O)c(c(c1C(=O)C=Cc1ccc(cc1)O)O)CC=C(C)C' "xanthomicrol": 'COc1c(OC)c(OC)c(c2c1oc(cc2=O)c1ccc(cc1)O)O' "xanthone": 'O=c1c2ccccc2oc2c1cccc2' "xanthosine": 'OCC1OC(C(C1O)O)n1cnc2c1[nH]c(=O)[nH]c2=O' "xanthostigmine": 'CNC(=O)Oc1cccc(c1)CN(CCCOc1ccc2c(c1)oc1c(c2=O)cccc1)C' "xanthydrol": 'OC1c2ccccc2Oc2c1cccc2' "xeroboside": 'COc1cc2ccc(=O)oc2cc1OC1OC(COC2OCC(C2O)(O)CO)C(C(C1O)O)O' "xylitol": 'OCC(C(C(CO)O)O)O' "xylopinine": 'COc1cc2CC3N(Cc2cc1OC)CCc1c3cc(OC)c(c1)OC' "xylose": 'OC1COC(C(C1O)O)O' "yohimbine": 'COC(=O)C1C(O)CCC2C1CC1N(C2)CCc2c1[nH]c1c2cccc1' "yttria": '[O-2].[O-2].[O-2].[Y+3].[Y+3]' "yuanhuadine": 'CCCCCC=CC=CC12OC3C(O1)(C(=C)C)C(C(C1(O2)C3C2OC2(C(C2(C1C=C(C2=O)C)O)O)CO)C)OC(=O)C' "yuanhuahine": 'CCCCCC=CC=CC12OC3C(O1)(C(=C)C)C(C(C1(O2)C3C2OC2(C(C2(C1C=C(C2=O)C)O)O)CO)C)OC(=O)CC' "zaleplon": 'CCN(c1cccc(c1)c1ccnc2n1ncc2C#N)C(=O)C' "zanamivir": 'OCC(C(C1OC(=CC(C1NC(=O)C)N=C(N)N)C(=O)O)O)O' "zearalenone": 'CC1CCCC(=O)CCCC=Cc2c(C(=O)O1)c(O)cc(c2)O' "zeaxanthin": 'OC1CC(=C(C(C1)(C)C)C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC1=C(C)CC(CC1(C)C)O)C)C)C)C)C' "zeranol": 'OC1CCCCCc2cc(O)cc(c2C(=O)OC(CCC1)C)O' "zidovudine": 'OCC1OC(CC1N=[N+]=[N-])n1cc(C)c(=O)[nH]c1=O' "zileuton": 'ON(C(c1cc2c(s1)cccc2)C)C(=O)N' "zingerone": 'COc1cc(CCC(=O)C)ccc1O' "ziprasidone": 'O=C1Nc2c(C1)cc(c(c2)Cl)CCN1CCN(CC1)c1nsc2c1cccc2' "zirconia": 'O=[Zr]=O' "zolpidem": 'Cc1ccc(cc1)c1nc2n(c1CC(=O)N(C)C)cc(cc2)C' "zoniporide": 'NC(=NC(=O)c1cnn(c1C1CC1)c1cccc2c1cccn2)N' "zonisamide": 'NS(=O)(=O)Cc1noc2c1cccc2' "zosuquidar": 'OC(CN1CCN(CC1)C1c2ccccc2C2C(c3c1cccc3)C2(F)F)COc1cccc2c1cccn2' "zotepine": 'CN(CCOC1=Cc2ccccc2Sc2c1cc(Cl)cc2)C'