Product OPENEYE NAME: 4-[cyclopropylmethyl(methyl)amino]-4-(3-hydroxyphenyl)cyclohexanone
CAS Name: 4-[cyclopropylmethyl(methyl)amino]-4-(3-hydroxyphenyl)-1-cyclohexanone
IUPAC NAME: 4-[cyclopropylmethyl(methyl)amino]-4-(3-hydroxyphenyl)cyclohexan-1-one
SYSTEMATIC NAME: 4-[cyclopropylmethyl(methyl)amino]-4-(3-hydroxyphenyl)cyclohexan-1-one
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: CN(CC1CC1)C2(CCC(=O)CC2)C3=CC(=CC=C3)O
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Product OPENEYE NAME: 2-(3-bromo-5-propoxy-phenyl)acetonitrile
CAS Name: 2-(3-bromo-5-propoxyphenyl)acetonitrile
IUPAC NAME: 2-(3-bromo-5-propoxyphenyl)acetonitrile
SYSTEMATIC NAME: 2-(3-bromanyl-5-propoxy-phenyl)ethanenitrile
MOLECULAR FORMULA: C11H12BrNO
MOLECULAR WEIGHT: 254.12308
SMILES: CCCOC1=CC(=CC(=C1)CC#N)Br
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Product OPENEYE NAME: 4-(4-chlorophenyl)-4-(dimethylamino)cyclohexanone hydrochloride
CAS Name: 4-(4-chlorophenyl)-4-(dimethylamino)-1-cyclohexanone hydrochloride
IUPAC NAME: 4-(4-chlorophenyl)-4-(dimethylamino)cyclohexan-1-one hydrochloride
SYSTEMATIC NAME: 4-(4-chlorophenyl)-4-(dimethylamino)cyclohexan-1-one hydrochloride
MOLECULAR FORMULA: C14H19Cl2NO
MOLECULAR WEIGHT: 288.21276
SMILES: CN(C)C1(CCC(=O)CC1)C2=CC=C(C=C2)Cl.Cl
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Product OPENEYE NAME: 4-(2-cyclopropylethylamino)-4-(3-hydroxyphenyl)cyclohexanone
CAS Name: 4-(2-cyclopropylethylamino)-4-(3-hydroxyphenyl)-1-cyclohexanone
IUPAC NAME: 4-(2-cyclopropylethylamino)-4-(3-hydroxyphenyl)cyclohexan-1-one
SYSTEMATIC NAME: 4-(2-cyclopropylethylamino)-4-(3-hydroxyphenyl)cyclohexan-1-one
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: C1CC1CCNC2(CCC(=O)CC2)C3=CC(=CC=C3)O
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Product OPENEYE NAME: 4-cyano-4-(3,4-dimethoxyphenyl)heptanedioic acid
CAS Name: 4-cyano-4-(3,4-dimethoxyphenyl)heptanedioic acid
IUPAC NAME: 4-cyano-4-(3,4-dimethoxyphenyl)heptanedioic acid
SYSTEMATIC NAME: 4-cyano-4-(3,4-dimethoxyphenyl)heptanedioic acid
MOLECULAR FORMULA: C16H19NO6
MOLECULAR WEIGHT: 321.32516
SMILES: COC1=C(C=C(C=C1)C(CCC(=O)O)(CCC(=O)O)C#N)OC
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Product OPENEYE NAME: 4-(4-tert-butylphenyl)-4-isocyanato-cyclohexanone; ethylene
CAS Name: 4-(4-tert-butylphenyl)-4-isocyanato-1-cyclohexanone; ethene
IUPAC NAME: 4-(4-tert-butylphenyl)-4-isocyanatocyclohexan-1-one; ethene
SYSTEMATIC NAME: 4-(4-tert-butylphenyl)-4-isocyanato-cyclohexan-1-one; ethene
MOLECULAR FORMULA: C19H25NO2
MOLECULAR WEIGHT: 299.4073
SMILES: CC(C)(C)C1=CC=C(C=C1)C2(CCC(=O)CC2)N=C=O.C=C
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Product OPENEYE NAME: 4-(4-tert-butylphenyl)-4-isocyanato-cyclohexanone
CAS Name: 4-(4-tert-butylphenyl)-4-isocyanato-1-cyclohexanone
IUPAC NAME: 4-(4-tert-butylphenyl)-4-isocyanatocyclohexan-1-one
SYSTEMATIC NAME: 4-(4-tert-butylphenyl)-4-isocyanato-cyclohexan-1-one
MOLECULAR FORMULA: C17H21NO2
MOLECULAR WEIGHT: 271.35414
SMILES: CC(C)(C)C1=CC=C(C=C1)C2(CCC(=O)CC2)N=C=O
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Product OPENEYE NAME: 1-(3,4-dimethoxyphenyl)-4-oxo-cyclohexanecarboxylic acid
CAS Name: 1-(3,4-dimethoxyphenyl)-4-oxo-1-cyclohexanecarboxylic acid
IUPAC NAME: 1-(3,4-dimethoxyphenyl)-4-oxocyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 1-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C15H18O5
MOLECULAR WEIGHT: 278.30042
SMILES: COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C(=O)O)OC
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Product OPENEYE NAME: ethylene; 4-(3-hydroxyphenyl)-4-[isobutyl(methyl)amino]cyclohexanone
CAS Name: ethene; 4-(3-hydroxyphenyl)-4-[methyl(2-methylpropyl)amino]-1-cyclohexanone
IUPAC NAME: ethene; 4-(3-hydroxyphenyl)-4-[methyl(2-methylpropyl)amino]cyclohexan-1-one
SYSTEMATIC NAME: ethene; 4-(3-hydroxyphenyl)-4-[methyl(2-methylpropyl)amino]cyclohexan-1-one
MOLECULAR FORMULA: C19H29NO2
MOLECULAR WEIGHT: 303.43906
SMILES: CC(C)CN(C)C1(CCC(=O)CC1)C2=CC(=CC=C2)O.C=C
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Product OPENEYE NAME: 4-(3-hydroxyphenyl)-4-[isobutyl(methyl)amino]cyclohexanone
CAS Name: 4-(3-hydroxyphenyl)-4-[methyl(2-methylpropyl)amino]-1-cyclohexanone
IUPAC NAME: 4-(3-hydroxyphenyl)-4-[methyl(2-methylpropyl)amino]cyclohexan-1-one
SYSTEMATIC NAME: 4-(3-hydroxyphenyl)-4-[methyl(2-methylpropyl)amino]cyclohexan-1-one
MOLECULAR FORMULA: C17H25NO2
MOLECULAR WEIGHT: 275.3859
SMILES: CC(C)CN(C)C1(CCC(=O)CC1)C2=CC(=CC=C2)O
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Product OPENEYE NAME: 4-isocyanato-4-[(3-methoxyphenyl)methyl]cyclohexanone
CAS Name: 4-isocyanato-4-[(3-methoxyphenyl)methyl]-1-cyclohexanone
IUPAC NAME: 4-isocyanato-4-[(3-methoxyphenyl)methyl]cyclohexan-1-one
SYSTEMATIC NAME: 4-isocyanato-4-[(3-methoxyphenyl)methyl]cyclohexan-1-one
MOLECULAR FORMULA: C15H17NO3
MOLECULAR WEIGHT: 259.30038
SMILES: COC1=CC=CC(=C1)CC2(CCC(=O)CC2)N=C=O
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Product OPENEYE NAME: 4-cyano-4-(2,4-dichlorophenyl)heptanedioic acid
CAS Name: 4-cyano-4-(2,4-dichlorophenyl)heptanedioic acid
IUPAC NAME: 4-cyano-4-(2,4-dichlorophenyl)heptanedioic acid
SYSTEMATIC NAME: 4-cyano-4-(2,4-dichlorophenyl)heptanedioic acid
MOLECULAR FORMULA: C14H13Cl2NO4
MOLECULAR WEIGHT: 330.16332
SMILES: C1=CC(=C(C=C1Cl)Cl)C(CCC(=O)O)(CCC(=O)O)C#N
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Product OPENEYE NAME: 4-(4-chlorophenyl)-4-isocyanato-cyclohexanone
CAS Name: 4-(4-chlorophenyl)-4-isocyanato-1-cyclohexanone
IUPAC NAME: 4-(4-chlorophenyl)-4-isocyanatocyclohexan-1-one
SYSTEMATIC NAME: 4-(4-chlorophenyl)-4-isocyanato-cyclohexan-1-one
MOLECULAR FORMULA: C13H12ClNO2
MOLECULAR WEIGHT: 249.69288
SMILES: C1CC(CCC1=O)(C2=CC=C(C=C2)Cl)N=C=O
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Product OPENEYE NAME: 4-amino-4-(3-methoxyphenyl)cyclohexanone; ethylene
CAS Name: 4-amino-4-(3-methoxyphenyl)-1-cyclohexanone; ethene
IUPAC NAME: 4-amino-4-(3-methoxyphenyl)cyclohexan-1-one; ethene
SYSTEMATIC NAME: 4-azanyl-4-(3-methoxyphenyl)cyclohexan-1-one; ethene
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: COC1=CC=CC(=C1)C2(CCC(=O)CC2)N.C=C
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Product OPENEYE NAME: 3-(4-chlorophenyl)-4-oxo-cyclohexanecarbonitrile
CAS Name: 3-(4-chlorophenyl)-4-oxo-1-cyclohexanecarbonitrile
IUPAC NAME: 3-(4-chlorophenyl)-4-oxocyclohexane-1-carbonitrile
SYSTEMATIC NAME: 3-(4-chlorophenyl)-4-oxidanylidene-cyclohexane-1-carbonitrile
MOLECULAR FORMULA: C13H12ClNO
MOLECULAR WEIGHT: 233.69348
SMILES: C1CC(=O)C(CC1C#N)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: ethylene; 4-isocyanato-4-phenyl-cyclohexanone
CAS Name: ethene; 4-isocyanato-4-phenyl-1-cyclohexanone
IUPAC NAME: ethene; 4-isocyanato-4-phenylcyclohexan-1-one
SYSTEMATIC NAME: ethene; 4-isocyanato-4-phenyl-cyclohexan-1-one
MOLECULAR FORMULA: C15H17NO2
MOLECULAR WEIGHT: 243.30098
SMILES: C=C.C1CC(CCC1=O)(C2=CC=CC=C2)N=C=O
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Product OPENEYE NAME: 4-isocyanato-4-phenyl-cyclohexanone
CAS Name: 4-isocyanato-4-phenyl-1-cyclohexanone
IUPAC NAME: 4-isocyanato-4-phenylcyclohexan-1-one
SYSTEMATIC NAME: 4-isocyanato-4-phenyl-cyclohexan-1-one
MOLECULAR FORMULA: C13H13NO2
MOLECULAR WEIGHT: 215.24782
SMILES: C1CC(CCC1=O)(C2=CC=CC=C2)N=C=O
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Product OPENEYE NAME: 4-(methylamino)-4-phenyl-cyclohexanone hydrochloride
CAS Name: 4-(methylamino)-4-phenyl-1-cyclohexanone hydrochloride
IUPAC NAME: 4-(methylamino)-4-phenylcyclohexan-1-one hydrochloride
SYSTEMATIC NAME: 4-(methylamino)-4-phenyl-cyclohexan-1-one hydrochloride
MOLECULAR FORMULA: C13H18ClNO
MOLECULAR WEIGHT: 239.74112
SMILES: CNC1(CCC(=O)CC1)C2=CC=CC=C2.Cl
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Product OPENEYE NAME: 1-(3-chlorophenyl)-4-oxo-cyclohexanecarboxylic acid
CAS Name: 1-(3-chlorophenyl)-4-oxo-1-cyclohexanecarboxylic acid
IUPAC NAME: 1-(3-chlorophenyl)-4-oxocyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 1-(3-chlorophenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C13H13ClO3
MOLECULAR WEIGHT: 252.69352
SMILES: C1CC(CCC1=O)(C2=CC(=CC=C2)Cl)C(=O)O
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Product OPENEYE NAME: 4-(2-chlorophenyl)-4-isocyanato-cyclohexanone
CAS Name: 4-(2-chlorophenyl)-4-isocyanato-1-cyclohexanone
IUPAC NAME: 4-(2-chlorophenyl)-4-isocyanatocyclohexan-1-one
SYSTEMATIC NAME: 4-(2-chlorophenyl)-4-isocyanato-cyclohexan-1-one
MOLECULAR FORMULA: C13H12ClNO2
MOLECULAR WEIGHT: 249.69288
SMILES: C1CC(CCC1=O)(C2=CC=CC=C2Cl)N=C=O
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Product OPENEYE NAME: 4-(3-bromo-5-propoxy-phenyl)-4-cyano-heptanedioic acid
CAS Name: 4-(3-bromo-5-propoxyphenyl)-4-cyanoheptanedioic acid
IUPAC NAME: 4-(3-bromo-5-propoxyphenyl)-4-cyanoheptanedioic acid
SYSTEMATIC NAME: 4-(3-bromanyl-5-propoxy-phenyl)-4-cyano-heptanedioic acid
MOLECULAR FORMULA: C17H20BrNO5
MOLECULAR WEIGHT: 398.2484
SMILES: CCCOC1=CC(=CC(=C1)C(CCC(=O)O)(CCC(=O)O)C#N)Br
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Product OPENEYE NAME: 4-(hexylamino)-4-(3-hydroxyphenyl)cyclohexanone
CAS Name: 4-(hexylamino)-4-(3-hydroxyphenyl)-1-cyclohexanone
IUPAC NAME: 4-(hexylamino)-4-(3-hydroxyphenyl)cyclohexan-1-one
SYSTEMATIC NAME: 4-(hexylamino)-4-(3-hydroxyphenyl)cyclohexan-1-one
MOLECULAR FORMULA: C18H27NO2
MOLECULAR WEIGHT: 289.41248
SMILES: CCCCCCNC1(CCC(=O)CC1)C2=CC(=CC=C2)O
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Product OPENEYE NAME: 4-(4-benzyloxyphenyl)-4-(methylamino)cyclohexanone; ethylene
CAS Name: ethene; 4-(methylamino)-4-(4-phenylmethoxyphenyl)-1-cyclohexanone
IUPAC NAME: ethene; 4-(methylamino)-4-(4-phenylmethoxyphenyl)cyclohexan-1-one
SYSTEMATIC NAME: ethene; 4-(methylamino)-4-(4-phenylmethoxyphenyl)cyclohexan-1-one
MOLECULAR FORMULA: C22H27NO2
MOLECULAR WEIGHT: 337.45528
SMILES: CNC1(CCC(=O)CC1)C2=CC=C(C=C2)OCC3=CC=CC=C3.C=C
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