Product OPENEYE NAME: [2-[(6S,11S,14S,16R)-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] hexanoate
CAS Name: hexanoic acid [2-[(6S,11S,14S,16R)-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester
IUPAC NAME: [2-[(6S,11S,14S,16R)-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hexanoate
SYSTEMATIC NAME: [2-[(6S,11S,14S,16R)-6-fluoranyl-10,13,16-trimethyl-11-oxidanyl-3-oxidanylidene-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] hexanoate
MOLECULAR FORMULA: C28H39FO5
MOLECULAR WEIGHT: 474.604663
SMILES: CCCCCC(=O)OCC(=O)C1[C@@H](C[C@@H]2C1(C[C@@H](C3C2C[C@@H](C4=CC(=O)C=CC34C)F)O)C)C
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Product OPENEYE NAME: 2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-isochromane-7-carbonyl]amino]-3-phenyl-propanoic acid
CAS Name: 2-[[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl]-oxomethyl]amino]-3-phenylpropanoic acid
IUPAC NAME: 2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[[(3R)-5-chloranyl-3-methyl-8-oxidanyl-1-oxidanylidene-3,4-dihydroisochromen-7-yl]carbonylamino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C20H18ClNO6
MOLECULAR WEIGHT: 403.81302
SMILES: C[C@@H]1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC3=CC=CC=C3)C(=O)O)Cl
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Product OPENEYE NAME: 2-ethyl-3-isobutyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ol
CAS Name: 2-ethyl-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ol
IUPAC NAME: 2-ethyl-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ol
SYSTEMATIC NAME: 2-ethyl-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ol
MOLECULAR FORMULA: C21H33NO3
MOLECULAR WEIGHT: 347.49162
SMILES: CCC1(CC2C3=CC(=C(C=C3CCN2CC1CC(C)C)OC)OC)O
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Product OPENEYE NAME: [(3R,4S,5R,6R)-5-hydroxy-6-[2-hydroxy-3-[[4-hydroxy-3-(3-methylbut-2-enyl)benzoyl]amino]-8-methyl-4-oxo-chromen-7-yl]oxy-3-methoxy-2,2-dimethyl-tetrahydropyran-4-yl] carbamate
CAS Name: carbamic acid [(3R,4S,5R,6R)-5-hydroxy-6-[[2-hydroxy-3-[[[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-oxomethyl]amino]-8-methyl-4-oxo-1-benzopyran-7-yl]oxy]-3-methoxy-2,2-dimethyl-4-oxanyl] ester
IUPAC NAME: [(3R,4S,5R,6R)-5-hydroxy-6-[2-hydroxy-3-[[4-hydroxy-3-(3-methylbut-2-enyl)benzoyl]amino]-8-methyl-4-oxochromen-7-yl]oxy-3-methoxy-2,2-dimethyloxan-4-yl] carbamate
SYSTEMATIC NAME: [(3R,4S,5R,6R)-3-methoxy-2,2-dimethyl-6-[8-methyl-3-[[3-(3-methylbut-2-enyl)-4-oxidanyl-phenyl]carbonylamino]-2-oxidanyl-4-oxidanylidene-chromen-7-yl]oxy-5-oxidanyl-oxan-4-yl] carbamate
MOLECULAR FORMULA: C31H36N2O11
MOLECULAR WEIGHT: 612.62434
SMILES: CC1=C(C=CC2=C1OC(=C(C2=O)NC(=O)C3=CC(=C(C=C3)O)CC=C(C)C)O)O[C@H]4[C@@H]([C@@H]([C@H](C(O4)(C)C)OC)OC(=O)N)O
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Product OPENEYE NAME: 2-(3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl)-5,6-dimethoxy-3-methyl-1,4-benzoquinone
CAS Name: 2-(3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
IUPAC NAME: 2-(3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2-(3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl)-5,6-dimethoxy-3-methyl-cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C44H66O4
MOLECULAR WEIGHT: 658.99244
SMILES: CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C
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Product OPENEYE NAME: 2-hydroxy-3-phenyl-benzoic acid
CAS Name: 2-hydroxy-3-phenylbenzoic acid
IUPAC NAME: 2-hydroxy-3-phenylbenzoic acid
SYSTEMATIC NAME: 2-oxidanyl-3-phenyl-benzoic acid
MOLECULAR FORMULA: C13H10O3
MOLECULAR WEIGHT: 214.2167
SMILES: C1=CC=C(C=C1)C2=C(C(=CC=C2)C(=O)O)O
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Product OPENEYE NAME: 1-(2,2-diphenylvinyl)-3-fluoro-benzene
CAS Name: 1-(2,2-diphenylethenyl)-3-fluorobenzene
IUPAC NAME: 1-(2,2-diphenylethenyl)-3-fluorobenzene
SYSTEMATIC NAME: 1-(2,2-diphenylethenyl)-3-fluoranyl-benzene
MOLECULAR FORMULA: C20H15F
MOLECULAR WEIGHT: 274.331503
SMILES: C1=CC=C(C=C1)C(=CC2=CC(=CC=C2)F)C3=CC=CC=C3
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Product OPENEYE NAME: phthalazin-1-ylhydrazine hydrochloride
CAS Name: 1-phthalazinylhydrazine hydrochloride
IUPAC NAME: phthalazin-1-ylhydrazine hydrochloride
SYSTEMATIC NAME: phthalazin-1-yldiazane hydrochloride
MOLECULAR FORMULA: C8H9ClN4
MOLECULAR WEIGHT: 196.63686
SMILES: C1=CC=C2C(=C1)C=NN=C2NN.Cl
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Product OPENEYE NAME: N-(7-acetamido-9H-fluoren-2-yl)acetamide
CAS Name: N-(7-acetamido-9H-fluoren-2-yl)acetamide
IUPAC NAME: N-(7-acetamido-9H-fluoren-2-yl)acetamide
SYSTEMATIC NAME: N-(7-acetamido-9H-fluoren-2-yl)ethanamide
MOLECULAR FORMULA: C17H16N2O2
MOLECULAR WEIGHT: 280.32114
SMILES: CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)NC(=O)C
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Product OPENEYE NAME: 1-(1H-indol-3-yl)-2-methyl-propan-2-amine
CAS Name: 1-(1H-indol-3-yl)-2-methyl-2-propanamine
IUPAC NAME: 1-(1H-indol-3-yl)-2-methylpropan-2-amine
SYSTEMATIC NAME: 1-(1H-indol-3-yl)-2-methyl-propan-2-amine
MOLECULAR FORMULA: C12H16N2
MOLECULAR WEIGHT: 188.26884
SMILES: CC(C)(CC1=CNC2=CC=CC=C21)N
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Product OPENEYE NAME: 2,3-bis(sulfanyl)butanedioic acid
CAS Name: 2,3-dimercaptobutanedioic acid
IUPAC NAME: 2,3-bis(sulfanyl)butanedioic acid
SYSTEMATIC NAME: 2,3-bis(sulfanyl)butanedioic acid
MOLECULAR FORMULA: C4H6O4S2
MOLECULAR WEIGHT: 182.21804
SMILES: C(C(C(=O)O)S)(C(=O)O)S
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Product OPENEYE NAME: 6-[2-(diisopropylamino)acetyl]oxy-2,3,4,5-tetrahydroxy-hexanoic acid
CAS Name: 6-[2-[di(propan-2-yl)amino]-1-oxoethoxy]-2,3,4,5-tetrahydroxyhexanoic acid
IUPAC NAME: 6-[2-[di(propan-2-yl)amino]acetyl]oxy-2,3,4,5-tetrahydroxyhexanoic acid
SYSTEMATIC NAME: 6-[2-[di(propan-2-yl)amino]ethanoyloxy]-2,3,4,5-tetrakis(oxidanyl)hexanoic acid
MOLECULAR FORMULA: C14H27NO8
MOLECULAR WEIGHT: 337.36608
SMILES: CC(C)N(CC(=O)OCC(C(C(C(C(=O)O)O)O)O)O)C(C)C
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Product OPENEYE NAME: potassium sodium (2R,3R)-2,3-dihydroxybutanedioate
CAS Name: potassium sodium (2R,3R)-2,3-dihydroxybutanedioate
IUPAC NAME: potassium sodium (2R,3R)-2,3-dihydroxybutanedioate
SYSTEMATIC NAME: potassium sodium (2R,3R)-2,3-bis(oxidanyl)butanedioate
MOLECULAR FORMULA: C4H4KNaO6
MOLECULAR WEIGHT: 210.15903
SMILES: [C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Na+].[K+]
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Product OPENEYE NAME: stibane
CAS Name: stibine
IUPAC NAME: stibane
SYSTEMATIC NAME: stibane
MOLECULAR FORMULA: H3Sb
MOLECULAR WEIGHT: 124.78382
SMILES: [SbH3]
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Product OPENEYE NAME: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione; 2,3,4,5,6-p
CAS Name: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[[4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyl-2-oxanyl)oxy]-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione; 2,3,4,5,6-pentahydroxyhexanoic
IUPAC NAME: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione; 2,3,4,5,6-pentahydroxyhexanoic acid
SYSTEMATIC NAME: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-14-ethyl-4-(4-methoxy-4,6-dimethyl-5-oxidanyl-oxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-7,12,13-tris(oxidanyl)-1-oxacyclotetradecane-2,10-dione; 2,3,4,5,6-pentakis(oxidan
MOLECULAR FORMULA: C43H79NO20
MOLECULAR WEIGHT: 930.08206
SMILES: CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H](C([C@@H]([C@H](C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O.C(C(C(C(C(C(=O)O)O)O)O)O)O
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Product OPENEYE NAME: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
CAS Name: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[[4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyl-2-oxanyl)oxy]-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
IUPAC NAME: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
SYSTEMATIC NAME: (3R,4S,6R,7R,9R,11R,12R,13S,14R)-6-[4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-14-ethyl-4-(4-methoxy-4,6-dimethyl-5-oxidanyl-oxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-7,12,13-tris(oxidanyl)-1-oxacyclotetradecane-2,10-dione
MOLECULAR FORMULA: C37H67NO13
MOLECULAR WEIGHT: 733.92678
SMILES: CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H](C([C@@H]([C@H](C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O
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Product OPENEYE NAME: 5-oxidophenazin-5-ium
CAS Name: 5-oxidophenazin-5-ium
IUPAC NAME: 5-oxidophenazin-5-ium
SYSTEMATIC NAME: 5-oxidanidylphenazin-5-ium
MOLECULAR FORMULA: C12H8N2O
MOLECULAR WEIGHT: 196.20472
SMILES: C1=CC=C2C(=C1)N=C3C=CC=CC3=[N+]2[O-]
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Product OPENEYE NAME: N,N-diethyl-4-hydroxy-3-methoxy-benzamide
CAS Name: N,N-diethyl-4-hydroxy-3-methoxybenzamide
IUPAC NAME: N,N-diethyl-4-hydroxy-3-methoxybenzamide
SYSTEMATIC NAME: N,N-diethyl-3-methoxy-4-oxidanyl-benzamide
MOLECULAR FORMULA: C12H17NO3
MOLECULAR WEIGHT: 223.26828
SMILES: CCN(CC)C(=O)C1=CC(=C(C=C1)O)OC
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Product OPENEYE NAME: N-[4-guanidino-1-(2-naphthylcarbamoyl)butyl]benzamide
CAS Name: N-[5-(diaminomethylideneamino)-1-(2-naphthalenylamino)-1-oxopentan-2-yl]benzamide
IUPAC NAME: N-[5-(diaminomethylideneamino)-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide
SYSTEMATIC NAME: N-[5-[bis(azanyl)methylideneamino]-1-(naphthalen-2-ylamino)-1-oxidanylidene-pentan-2-yl]benzamide
MOLECULAR FORMULA: C23H25N5O2
MOLECULAR WEIGHT: 403.4769
SMILES: C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)NC2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: (2,5-dichlorophenyl)hydrazine
CAS Name: (2,5-dichlorophenyl)hydrazine
IUPAC NAME: (2,5-dichlorophenyl)hydrazine
SYSTEMATIC NAME: [2,5-bis(chloranyl)phenyl]diazane
MOLECULAR FORMULA: C6H6Cl2N2
MOLECULAR WEIGHT: 177.03124
SMILES: C1=CC(=C(C=C1Cl)NN)Cl
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