Product OPENEYE NAME: tetralin-1-one
CAS Name: 3,4-dihydro-2H-naphthalen-1-one
IUPAC NAME: 3,4-dihydro-2H-naphthalen-1-one
SYSTEMATIC NAME: 3,4-dihydro-2H-naphthalen-1-one
MOLECULAR FORMULA: C10H10O
MOLECULAR WEIGHT: 146.1858
SMILES: C1CC2=CC=CC=C2C(=O)C1
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Product OPENEYE NAME: 3-hydroxy-2-phenyl-propanoic acid
CAS Name: 3-hydroxy-2-phenylpropanoic acid
IUPAC NAME: 3-hydroxy-2-phenylpropanoic acid
SYSTEMATIC NAME: 3-oxidanyl-2-phenyl-propanoic acid
MOLECULAR FORMULA: C9H10O3
MOLECULAR WEIGHT: 166.1739
SMILES: C1=CC=C(C=C1)C(CO)C(=O)O
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Product OPENEYE NAME: N-ethyl-N-phenyl-acetamide
CAS Name: N-ethyl-N-phenylacetamide
IUPAC NAME: N-ethyl-N-phenylacetamide
SYSTEMATIC NAME: N-ethyl-N-phenyl-ethanamide
MOLECULAR FORMULA: C10H13NO
MOLECULAR WEIGHT: 163.21632
SMILES: CCN(C1=CC=CC=C1)C(=O)C
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Product OPENEYE NAME: ethyl 2-acetoxybenzoate
CAS Name: 2-acetyloxybenzoic acid ethyl ester
IUPAC NAME: ethyl 2-acetyloxybenzoate
SYSTEMATIC NAME: ethyl 2-acetyloxybenzoate
MOLECULAR FORMULA: C11H12O4
MOLECULAR WEIGHT: 208.21058
SMILES: CCOC(=O)C1=CC=CC=C1OC(=O)C
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Product OPENEYE NAME: 2-amino-1,8-dihydropteridine-4,7-dione
CAS Name: 2-amino-1,8-dihydropteridine-4,7-dione
IUPAC NAME: 2-amino-1,8-dihydropteridine-4,7-dione
SYSTEMATIC NAME: 2-azanyl-1,8-dihydropteridine-4,7-dione
MOLECULAR FORMULA: C6H5N5O2
MOLECULAR WEIGHT: 179.1362
SMILES: C1=NC2=C(NC1=O)NC(=NC2=O)N
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Product OPENEYE NAME: anthracen-9-ol
CAS Name: 9-anthracenol
IUPAC NAME: anthracen-9-ol
SYSTEMATIC NAME: anthracen-9-ol
MOLECULAR FORMULA: C14H10O
MOLECULAR WEIGHT: 194.2286
SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2O
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Product OPENEYE NAME: ammonia; 2-hydroxy-2-phenyl-acetic acid
CAS Name: ammonia; 2-hydroxy-2-phenylacetic acid
IUPAC NAME: azane; 2-hydroxy-2-phenylacetic acid
SYSTEMATIC NAME: azane; 2-oxidanyl-2-phenyl-ethanoic acid
MOLECULAR FORMULA: C8H11NO3
MOLECULAR WEIGHT: 169.17784
SMILES: C1=CC=C(C=C1)C(C(=O)O)O.N
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Product OPENEYE NAME: ethyl-(2-hydroxy-1-methyl-2-phenyl-ethyl)-methyl-ammonium chloride
CAS Name: ethyl-(1-hydroxy-1-phenylpropan-2-yl)-methylammonium chloride
IUPAC NAME: ethyl-(1-hydroxy-1-phenylpropan-2-yl)-methylazanium chloride
SYSTEMATIC NAME: ethyl-methyl-(1-oxidanyl-1-phenyl-propan-2-yl)azanium chloride
MOLECULAR FORMULA: C12H20ClNO
MOLECULAR WEIGHT: 229.7463
SMILES: CC[NH+](C)C(C)C(C1=CC=CC=C1)O.[Cl-]
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Product OPENEYE NAME: 2-[ethyl(methyl)amino]-1-phenyl-propan-1-ol
CAS Name: 2-[ethyl(methyl)amino]-1-phenyl-1-propanol
IUPAC NAME: 2-[ethyl(methyl)amino]-1-phenylpropan-1-ol
SYSTEMATIC NAME: 2-[ethyl(methyl)amino]-1-phenyl-propan-1-ol
MOLECULAR FORMULA: C12H19NO
MOLECULAR WEIGHT: 193.28536
SMILES: CCN(C)C(C)C(C1=CC=CC=C1)O
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Product OPENEYE NAME: N,N-diethylpyridine-4-carboxamide
CAS Name: N,N-diethyl-4-pyridinecarboxamide
IUPAC NAME: N,N-diethylpyridine-4-carboxamide
SYSTEMATIC NAME: N,N-diethylpyridine-4-carboxamide
MOLECULAR FORMULA: C10H14N2O
MOLECULAR WEIGHT: 178.23096
SMILES: CCN(CC)C(=O)C1=CC=NC=C1
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Product OPENEYE NAME: [2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl] hexadecanoate
CAS Name: hexadecanoic acid [2-[(2,2-dichloro-1-oxoethyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl] ester
IUPAC NAME: [2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl] hexadecanoate
SYSTEMATIC NAME: [2-[2,2-bis(chloranyl)ethanoylamino]-3-(4-nitrophenyl)-3-oxidanyl-propyl] hexadecanoate
MOLECULAR FORMULA: C27H42Cl2N2O6
MOLECULAR WEIGHT: 561.53818
SMILES: CCCCCCCCCCCCCCCC(=O)OCC(C(C1=CC=C(C=C1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl
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Product OPENEYE NAME: [4-(dimethylamino)phenyl]-phenyl-methanone
CAS Name: [4-(dimethylamino)phenyl]-phenylmethanone
IUPAC NAME: [4-(dimethylamino)phenyl]-phenylmethanone
SYSTEMATIC NAME: [4-(dimethylamino)phenyl]-phenyl-methanone
MOLECULAR FORMULA: C15H15NO
MOLECULAR WEIGHT: 225.2857
SMILES: CN(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 1,1-diphenylhydrazine hydrochloride
CAS Name: 1,1-diphenylhydrazine hydrochloride
IUPAC NAME: 1,1-diphenylhydrazine hydrochloride
SYSTEMATIC NAME: 1,1-diphenyldiazane hydrochloride
MOLECULAR FORMULA: C12H13ClN2
MOLECULAR WEIGHT: 220.69802
SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)N.Cl
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Product OPENEYE NAME: 1,1-diphenylhydrazine
CAS Name: 1,1-diphenylhydrazine
IUPAC NAME: 1,1-diphenylhydrazine
SYSTEMATIC NAME: 1,1-diphenyldiazane
MOLECULAR FORMULA: C12H12N2
MOLECULAR WEIGHT: 184.23708
SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)N
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Product OPENEYE NAME: 1-phenylvinylbenzene
CAS Name: 1-phenylethenylbenzene
IUPAC NAME: 1-phenylethenylbenzene
SYSTEMATIC NAME: 1-phenylethenylbenzene
MOLECULAR FORMULA: C14H12
MOLECULAR WEIGHT: 180.24508
SMILES: C=C(C1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: 4-(hydroxymethyl)-2,6-dimethoxy-phenol
CAS Name: 4-(hydroxymethyl)-2,6-dimethoxyphenol
IUPAC NAME: 4-(hydroxymethyl)-2,6-dimethoxyphenol
SYSTEMATIC NAME: 4-(hydroxymethyl)-2,6-dimethoxy-phenol
MOLECULAR FORMULA: C9H12O4
MOLECULAR WEIGHT: 184.18918
SMILES: COC1=CC(=CC(=C1O)OC)CO
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Product OPENEYE NAME: 4-hydroxy-3,5-dimethoxy-benzoic acid
CAS Name: 4-hydroxy-3,5-dimethoxybenzoic acid
IUPAC NAME: 4-hydroxy-3,5-dimethoxybenzoic acid
SYSTEMATIC NAME: 3,5-dimethoxy-4-oxidanyl-benzoic acid
MOLECULAR FORMULA: C9H10O5
MOLECULAR WEIGHT: 198.1727
SMILES: COC1=CC(=CC(=C1O)OC)C(=O)O
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