Product OPENEYE NAME: 2-(methylamino)-1-phenyl-propan-1-ol hydrochloride
CAS Name: 2-(methylamino)-1-phenyl-1-propanol hydrochloride
IUPAC NAME: 2-(methylamino)-1-phenylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 2-(methylamino)-1-phenyl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C10H16ClNO
MOLECULAR WEIGHT: 201.69314
SMILES: CC(C(C1=CC=CC=C1)O)NC.Cl
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Product OPENEYE NAME: (2S)-2-(methylamino)-1-phenyl-propan-1-ol
CAS Name: (2S)-2-(methylamino)-1-phenyl-1-propanol
IUPAC NAME: (2S)-2-(methylamino)-1-phenylpropan-1-ol
SYSTEMATIC NAME: (2S)-2-(methylamino)-1-phenyl-propan-1-ol
MOLECULAR FORMULA: C10H15NO
MOLECULAR WEIGHT: 165.2322
SMILES: C[C@@H](C(C1=CC=CC=C1)O)NC
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Product OPENEYE NAME: 1,2-diphenylethane-1,2-dione
CAS Name: 1,2-diphenylethane-1,2-dione
IUPAC NAME: 1,2-diphenylethane-1,2-dione
SYSTEMATIC NAME: 1,2-diphenylethane-1,2-dione
MOLECULAR FORMULA: C14H10O2
MOLECULAR WEIGHT: 210.228
SMILES: C1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: phenyl(p-tolyl)methanone
CAS Name: (4-methylphenyl)-phenylmethanone
IUPAC NAME: (4-methylphenyl)-phenylmethanone
SYSTEMATIC NAME: (4-methylphenyl)-phenyl-methanone
MOLECULAR FORMULA: C14H12O
MOLECULAR WEIGHT: 196.24448
SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: (4-chlorophenyl)-phenyl-methanone
CAS Name: (4-chlorophenyl)-phenylmethanone
IUPAC NAME: (4-chlorophenyl)-phenylmethanone
SYSTEMATIC NAME: (4-chlorophenyl)-phenyl-methanone
MOLECULAR FORMULA: C13H9ClO
MOLECULAR WEIGHT: 216.66296
SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: calcium 2-hydroxy-2-phenyl-acetate
CAS Name: calcium 2-hydroxy-2-phenylacetate
IUPAC NAME: calcium 2-hydroxy-2-phenylacetate
SYSTEMATIC NAME: calcium 2-oxidanyl-2-phenyl-ethanoate
MOLECULAR FORMULA: C16H14CaO6
MOLECULAR WEIGHT: 342.35676
SMILES: C1=CC=C(C=C1)C(C(=O)[O-])O.C1=CC=C(C=C1)C(C(=O)[O-])O.[Ca+2]
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Product OPENEYE NAME: 4-hydroxy-3,5-dimethoxy-benzaldehyde
CAS Name: 4-hydroxy-3,5-dimethoxybenzaldehyde
IUPAC NAME: 4-hydroxy-3,5-dimethoxybenzaldehyde
SYSTEMATIC NAME: 3,5-dimethoxy-4-oxidanyl-benzaldehyde
MOLECULAR FORMULA: C9H10O4
MOLECULAR WEIGHT: 182.1733
SMILES: COC1=CC(=CC(=C1O)OC)C=O
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Product OPENEYE NAME: N-(2,3-dimethylphenyl)acetamide
CAS Name: N-(2,3-dimethylphenyl)acetamide
IUPAC NAME: N-(2,3-dimethylphenyl)acetamide
SYSTEMATIC NAME: N-(2,3-dimethylphenyl)ethanamide
MOLECULAR FORMULA: C10H13NO
MOLECULAR WEIGHT: 163.21632
SMILES: CC1=C(C(=CC=C1)NC(=O)C)C
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Product OPENEYE NAME: 1,2-diethylbenzene
CAS Name: 1,2-diethylbenzene
IUPAC NAME: 1,2-diethylbenzene
SYSTEMATIC NAME: 1,2-diethylbenzene
MOLECULAR FORMULA: C10H14
MOLECULAR WEIGHT: 134.21816
SMILES: CCC1=CC=CC=C1CC
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Product OPENEYE NAME: 2-methoxybenzaldehyde
CAS Name: 2-methoxybenzaldehyde
IUPAC NAME: 2-methoxybenzaldehyde
SYSTEMATIC NAME: 2-methoxybenzaldehyde
MOLECULAR FORMULA: C8H8O2
MOLECULAR WEIGHT: 136.14792
SMILES: COC1=CC=CC=C1C=O
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Product OPENEYE NAME: 4-chloro-1-(4-chlorophenoxy)-2-nitro-benzene
CAS Name: 4-chloro-1-(4-chlorophenoxy)-2-nitrobenzene
IUPAC NAME: 4-chloro-1-(4-chlorophenoxy)-2-nitrobenzene
SYSTEMATIC NAME: 4-chloranyl-1-(4-chloranylphenoxy)-2-nitro-benzene
MOLECULAR FORMULA: C12H7Cl2NO3
MOLECULAR WEIGHT: 284.09488
SMILES: C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])Cl
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Product OPENEYE NAME: 2-(carboxymethylsulfanyl)benzoic acid
CAS Name: 2-(carboxymethylthio)benzoic acid
IUPAC NAME: 2-(carboxymethylsulfanyl)benzoic acid
SYSTEMATIC NAME: 2-(2-hydroxy-2-oxoethylsulfanyl)benzoic acid
MOLECULAR FORMULA: C9H8O4S
MOLECULAR WEIGHT: 212.22242
SMILES: C1=CC=C(C(=C1)C(=O)O)SCC(=O)O
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Product OPENEYE NAME: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea; methyl sulfate
CAS Name: 1,3-bis(1-methyl-6-quinolin-1-iumyl)urea; methyl sulfate
IUPAC NAME: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea; methyl sulfate
SYSTEMATIC NAME: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea; methyl sulfate
MOLECULAR FORMULA: C23H26N4O9S2
MOLECULAR WEIGHT: 566.60394
SMILES: C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)NC3=CC4=C(C=C3)[N+](=CC=C4)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]
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Product OPENEYE NAME: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea
CAS Name: 1,3-bis(1-methyl-6-quinolin-1-iumyl)urea
IUPAC NAME: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea
SYSTEMATIC NAME: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea
MOLECULAR FORMULA: C21H20N4O+2
MOLECULAR WEIGHT: 344.4097
SMILES: C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)NC3=CC4=C(C=C3)[N+](=CC=C4)C
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Product OPENEYE NAME: naphthalen-2-ol
CAS Name: 2-naphthalenol
IUPAC NAME: naphthalen-2-ol
SYSTEMATIC NAME: naphthalen-2-ol
MOLECULAR FORMULA: C10H8O
MOLECULAR WEIGHT: 144.16992
SMILES: C1=CC=C2C=C(C=CC2=C1)O
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Product OPENEYE NAME: ammonia; N-hydroxy-N-phenyl-nitrous amide
CAS Name: ammonia; N-hydroxy-N-phenylnitrous amide
IUPAC NAME: azane; N-hydroxy-N-phenylnitrous amide
SYSTEMATIC NAME: azane; N-oxidanyl-N-phenyl-nitrous amide
MOLECULAR FORMULA: C6H9N3O2
MOLECULAR WEIGHT: 155.15456
SMILES: C1=CC=C(C=C1)N(N=O)O.N
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Product OPENEYE NAME: N-hydroxy-N-phenyl-nitrous amide
CAS Name: N-hydroxy-N-phenylnitrous amide
IUPAC NAME: N-hydroxy-N-phenylnitrous amide
SYSTEMATIC NAME: N-oxidanyl-N-phenyl-nitrous amide
MOLECULAR FORMULA: C6H6N2O2
MOLECULAR WEIGHT: 138.12404
SMILES: C1=CC=C(C=C1)N(N=O)O
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