Product OPENEYE NAME: (1R,2S)-2-phenylcyclopropanamine
CAS Name: (1R,2S)-2-phenyl-1-cyclopropanamine
IUPAC NAME: (1R,2S)-2-phenylcyclopropan-1-amine
SYSTEMATIC NAME: (1R,2S)-2-phenylcyclopropan-1-amine
MOLECULAR FORMULA: C9H11N
MOLECULAR WEIGHT: [(1R,2S)-2-phenylcyclopropyl]amine
SMILES: C1[C@H]([C@@H]1N)C2=CC=CC=C2
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Product OPENEYE NAME: cyclobutanecarboxylic acid
CAS Name: cyclobutanecarboxylic acid
IUPAC NAME: cyclobutanecarboxylic acid
SYSTEMATIC NAME: cyclobutanecarboxylic acid
MOLECULAR FORMULA: C5H8O2
MOLECULAR WEIGHT: 100.11582
SMILES: C1CC(C1)C(=O)O
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Product OPENEYE NAME: 2-[(4-nitrophenyl)hydrazono]propanedinitrile
CAS Name: 2-[(4-nitrophenyl)hydrazinylidene]propanedinitrile
IUPAC NAME: 2-[(4-nitrophenyl)hydrazinylidene]propanedinitrile
SYSTEMATIC NAME: 2-[(4-nitrophenyl)hydrazinylidene]propanedinitrile
MOLECULAR FORMULA: C9H5N5O2
MOLECULAR WEIGHT: 215.1683
SMILES: C1=CC(=CC=C1NN=C(C#N)C#N)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(4-nitrophenyl)azopropanedinitrile
CAS Name: 2-(4-nitrophenyl)azopropanedinitrile
IUPAC NAME: 2-[(4-nitrophenyl)diazenyl]propanedinitrile
SYSTEMATIC NAME: 2-[(4-nitrophenyl)diazenyl]propanedinitrile
MOLECULAR FORMULA: C9H5N5O2
MOLECULAR WEIGHT: 215.1683
SMILES: C1=CC(=CC=C1N=NC(C#N)C#N)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(m-tolylazo)propanedinitrile
CAS Name: 2-(3-methylphenyl)azopropanedinitrile
IUPAC NAME: 2-[(3-methylphenyl)diazenyl]propanedinitrile
SYSTEMATIC NAME: 2-[(3-methylphenyl)diazenyl]propanedinitrile
MOLECULAR FORMULA: C10H8N4
MOLECULAR WEIGHT: 184.19732
SMILES: CC1=CC(=CC=C1)N=NC(C#N)C#N
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Product OPENEYE NAME: 2-methylsulfanylbenzoic acid
CAS Name: 2-(methylthio)benzoic acid
IUPAC NAME: 2-methylsulfanylbenzoic acid
SYSTEMATIC NAME: 2-methylsulfanylbenzoic acid
MOLECULAR FORMULA: C8H8O2S
MOLECULAR WEIGHT: 168.21292
SMILES: CSC1=CC=CC=C1C(=O)O
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Product OPENEYE NAME: but-2-enoic acid
CAS Name: 2-butenoic acid
IUPAC NAME: but-2-enoic acid
SYSTEMATIC NAME: but-2-enoic acid
MOLECULAR FORMULA: C4H6O2
MOLECULAR WEIGHT: 86.08924
SMILES: CC=CC(=O)O
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Product OPENEYE NAME: 1-ethyl-3-methyl-cyclopentane
CAS Name: 1-ethyl-3-methylcyclopentane
IUPAC NAME: 1-ethyl-3-methylcyclopentane
SYSTEMATIC NAME: 1-ethyl-3-methyl-cyclopentane
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCC1CCC(C1)C
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Product OPENEYE NAME: 1-ethyl-4-methyl-cyclohexane
CAS Name: 1-ethyl-4-methylcyclohexane
IUPAC NAME: 1-ethyl-4-methylcyclohexane
SYSTEMATIC NAME: 1-ethyl-4-methyl-cyclohexane
MOLECULAR FORMULA: C9H18
MOLECULAR WEIGHT: 126.23922
SMILES: CCC1CCC(CC1)C
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Product OPENEYE NAME: ethyl 2-diethoxyphosphoryloxy-3-oxo-butanoate
CAS Name: 2-diethoxyphosphoryloxy-3-oxobutanoic acid ethyl ester
IUPAC NAME: ethyl 2-diethoxyphosphoryloxy-3-oxobutanoate
SYSTEMATIC NAME: ethyl 2-diethoxyphosphoryloxy-3-oxidanylidene-butanoate
MOLECULAR FORMULA: C10H19O7P
MOLECULAR WEIGHT: 282.227421
SMILES: CCOC(=O)C(C(=O)C)OP(=O)(OCC)OCC
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Product OPENEYE NAME: methyl (1R,4aR)-1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
CAS Name: (1R,4aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester
IUPAC NAME: methyl (1R,4aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
SYSTEMATIC NAME: methyl (1R,4aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
MOLECULAR FORMULA: C21H32O2
MOLECULAR WEIGHT: 316.47758
SMILES: C[C@]12CCC[C@@](C1CCC3=CC(CCC23)(C)C=C)(C)C(=O)OC
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Product OPENEYE NAME: 2,5-dimethylhexan-2-ol
CAS Name: 2,5-dimethyl-2-hexanol
IUPAC NAME: 2,5-dimethylhexan-2-ol
SYSTEMATIC NAME: 2,5-dimethylhexan-2-ol
MOLECULAR FORMULA: C8H18O
MOLECULAR WEIGHT: 130.22792
SMILES: CC(C)CCC(C)(C)O
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Product OPENEYE NAME: quinuclidin-3-one
CAS Name: 1-azabicyclo[2.2.2]octan-3-one
IUPAC NAME: 1-azabicyclo[2.2.2]octan-3-one
SYSTEMATIC NAME: 1-azabicyclo[2.2.2]octan-3-one
MOLECULAR FORMULA: C7H11NO
MOLECULAR WEIGHT: 125.16834
SMILES: C1CN2CCC1C(=O)C2
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Product OPENEYE NAME: N,N-dimethyl-4-(o-tolylazo)aniline
CAS Name: N,N-dimethyl-4-(2-methylphenyl)azoaniline
IUPAC NAME: N,N-dimethyl-4-[(2-methylphenyl)diazenyl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[(2-methylphenyl)diazenyl]aniline
MOLECULAR FORMULA: C15H17N3
MOLECULAR WEIGHT: 239.31558
SMILES: CC1=CC=CC=C1N=NC2=CC=C(C=C2)N(C)C
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Product OPENEYE NAME: 2-pyridylmethanamine
CAS Name: 2-pyridinylmethanamine
IUPAC NAME: pyridin-2-ylmethanamine
SYSTEMATIC NAME: pyridin-2-ylmethanamine
MOLECULAR FORMULA: C6H8N2
MOLECULAR WEIGHT: 108.14112
SMILES: C1=CC=NC(=C1)CN
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