CAS RN: 214262-94-9
CAS Name: 1-(2-chloro-6-fluorophenyl)-1-cyclopentanecarbonitrile
OPENEYE Name: 1-(2-chloro-6-fluoro-phenyl)cyclopentanecarbonitrile
IUPAC Name: 1-(2-chloro-6-fluorophenyl)cyclopentane-1-carbonitrile
SYSTEMATIC NAME: 1-(2-chloranyl-6-fluoranyl-phenyl)cyclopentane-1-carbonitrile
MOLECULAR FORMULA: C12H11ClFN
MOLECULAR WEIGHT: 223.673843
SMILES: C1CCC(C1)(C#N)C2=C(C=CC=C2Cl)F
Structure:
CAS RN: 214262-93-8
CAS Name: 1-(2-chloro-4-fluorophenyl)-1-cyclohexanecarbonitrile
OPENEYE Name: 1-(2-chloro-4-fluoro-phenyl)cyclohexanecarbonitrile
IUPAC Name: 1-(2-chloro-4-fluorophenyl)cyclohexane-1-carbonitrile
SYSTEMATIC NAME: 1-(2-chloranyl-4-fluoranyl-phenyl)cyclohexane-1-carbonitrile
MOLECULAR FORMULA: C13H13ClFN
MOLECULAR WEIGHT: 237.700423
SMILES: C1CCC(CC1)(C#N)C2=C(C=C(C=C2)F)Cl
Structure:
CAS RN: 214262-92-7
CAS Name: 1-(2-chloro-4-fluorophenyl)-1-cyclopentanecarbonitrile
OPENEYE Name: 1-(2-chloro-4-fluoro-phenyl)cyclopentanecarbonitrile
IUPAC Name: 1-(2-chloro-4-fluorophenyl)cyclopentane-1-carbonitrile
SYSTEMATIC NAME: 1-(2-chloranyl-4-fluoranyl-phenyl)cyclopentane-1-carbonitrile
MOLECULAR FORMULA: C12H11ClFN
MOLECULAR WEIGHT: 223.673843
SMILES: C1CCC(C1)(C#N)C2=C(C=C(C=C2)F)Cl
Structure:
CAS RN: 214262-91-6
CAS Name: 1-(3-fluorophenyl)-1-cyclohexanecarbonitrile
OPENEYE Name: 1-(3-fluorophenyl)cyclohexanecarbonitrile
IUPAC Name: 1-(3-fluorophenyl)cyclohexane-1-carbonitrile
SYSTEMATIC NAME: 1-(3-fluorophenyl)cyclohexane-1-carbonitrile
MOLECULAR FORMULA: C13H14FN
MOLECULAR WEIGHT: 203.255363
SMILES: C1CCC(CC1)(C#N)C2=CC(=CC=C2)F
Structure:
CAS RN: 106795-72-6
CAS Name: 1-(2-fluorophenyl)-1-cyclohexanecarbonitrile
OPENEYE Name: 1-(2-fluorophenyl)cyclohexanecarbonitrile
IUPAC Name: 1-(2-fluorophenyl)cyclohexane-1-carbonitrile
SYSTEMATIC NAME: 1-(2-fluorophenyl)cyclohexane-1-carbonitrile
MOLECULAR FORMULA: C13H14FN
MOLECULAR WEIGHT: 203.255363
SMILES: C1CCC(CC1)(C#N)C2=CC=CC=C2F
Structure:
CAS RN: 214262-88-1
CAS Name: 2-(2-chloro-4-fluorophenyl)acetic acid methyl ester
OPENEYE Name: methyl 2-(2-chloro-4-fluoro-phenyl)acetate
IUPAC Name: methyl 2-(2-chloro-4-fluorophenyl)acetate
SYSTEMATIC NAME: methyl 2-(2-chloranyl-4-fluoranyl-phenyl)ethanoate
MOLECULAR FORMULA: C9H8ClFO2
MOLECULAR WEIGHT: 202.610023
SMILES: COC(=O)CC1=C(C=C(C=C1)F)Cl
Structure:
CAS RN: 41526-42-5
CAS Name: 3-(chloromethyl)-1,3-benzothiazole-2-thione
OPENEYE Name: 3-(chloromethyl)-1,3-benzothiazole-2-thione
IUPAC Name: 3-(chloromethyl)-1,3-benzothiazole-2-thione
SYSTEMATIC NAME: 3-(chloromethyl)-1,3-benzothiazole-2-thione
MOLECULAR FORMULA: C8H6ClNS2
MOLECULAR WEIGHT: 215.72294
SMILES: C1=CC=C2C(=C1)N(C(=S)S2)CCl
Structure:
CAS RN: 1018-79-7
CAS Name: (1R)-2-benzoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-1-carbonitrile
OPENEYE Name: (1R)-2-benzoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-1-carbonitrile
IUPAC Name: (1R)-2-benzoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-1-carbonitrile
SYSTEMATIC NAME: (1R)-6,7-dimethoxy-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-1-carbonitrile
MOLECULAR FORMULA: C19H18N2O3
MOLECULAR WEIGHT: 322.35782
SMILES: COC1=C(C=C2[C@@H](N(CCC2=C1)C(=O)C3=CC=CC=C3)C#N)OC
Structure:
CAS RN: 10187-86-7
CAS Name: (1S)-2-benzoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-1-carbonitrile
OPENEYE Name: (1S)-2-benzoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-1-carbonitrile
IUPAC Name: (1S)-2-benzoyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-1-carbonitrile
SYSTEMATIC NAME: (1S)-6,7-dimethoxy-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-1-carbonitrile
MOLECULAR FORMULA: C19H18N2O3
MOLECULAR WEIGHT: 322.35782
SMILES: COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)C3=CC=CC=C3)C#N)OC
Structure:
CAS RN: 67644-00-2
CAS Name: (2-fluorophenyl)-(4-methoxy-3-nitrophenyl)methanone
OPENEYE Name: (2-fluorophenyl)-(4-methoxy-3-nitro-phenyl)methanone
IUPAC Name: (2-fluorophenyl)-(4-methoxy-3-nitrophenyl)methanone
SYSTEMATIC NAME: (2-fluorophenyl)-(4-methoxy-3-nitro-phenyl)methanone
MOLECULAR FORMULA: C14H10FNO4
MOLECULAR WEIGHT: 275.231903
SMILES: COC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2F)[N+](=O)[O-]
Structure:
CAS RN: 77414-25-6
CAS Name: 1-(4-bromophenyl)-2-pyrrolidinone
OPENEYE Name: 1-(4-bromophenyl)pyrrolidin-2-one
IUPAC Name: 1-(4-bromophenyl)pyrrolidin-2-one
SYSTEMATIC NAME: 1-(4-bromophenyl)pyrrolidin-2-one
MOLECULAR FORMULA: C10H10BrNO
MOLECULAR WEIGHT: 240.0965
SMILES: C1CC(=O)N(C1)C2=CC=C(C=C2)Br
Structure:
CAS RN: 6764-43-8
CAS Name: (3-chlorophenyl)-(4-methoxy-3-nitrophenyl)methanone
OPENEYE Name: (3-chlorophenyl)-(4-methoxy-3-nitro-phenyl)methanone
IUPAC Name: (3-chlorophenyl)-(4-methoxy-3-nitrophenyl)methanone
SYSTEMATIC NAME: (3-chlorophenyl)-(4-methoxy-3-nitro-phenyl)methanone
MOLECULAR FORMULA: C14H10ClNO4
MOLECULAR WEIGHT: 291.6865
SMILES: COC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)Cl)[N+](=O)[O-]
Structure:
CAS RN: 113269-09-3
CAS Name: 6-bromo-7-nitroquinoxaline
OPENEYE Name: 6-bromo-7-nitro-quinoxaline
IUPAC Name: 6-bromo-7-nitroquinoxaline
SYSTEMATIC NAME: 6-bromanyl-7-nitro-quinoxaline
MOLECULAR FORMULA: C8H4BrN3O2
MOLECULAR WEIGHT: 254.04026
SMILES: C1=NC2=CC(=C(C=C2N=C1)Br)[N+](=O)[O-]
Structure:
CAS RN: 109541-21-1
CAS Name: 6-chloro-7-nitroquinoxaline
OPENEYE Name: 6-chloro-7-nitro-quinoxaline
IUPAC Name: 6-chloro-7-nitroquinoxaline
SYSTEMATIC NAME: 6-chloranyl-7-nitro-quinoxaline
MOLECULAR FORMULA: C8H4ClN3O2
MOLECULAR WEIGHT: 209.58926
SMILES: C1=NC2=CC(=C(C=C2N=C1)Cl)[N+](=O)[O-]
Structure:
CAS RN: 1142-20-7
CAS Name: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid
OPENEYE Name: (2S)-2-(benzyloxycarbonylamino)propanoic acid
IUPAC Name: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid
SYSTEMATIC NAME: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid
MOLECULAR FORMULA: C11H13NO4
MOLECULAR WEIGHT: 223.22522
SMILES: C[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1
Structure:
CAS RN: 84604-70-6
CAS Name: 1-(2,4-dichlorophenyl)-1-cyclopropanecarboxylic acid
OPENEYE Name: 1-(2,4-dichlorophenyl)cyclopropanecarboxylic acid
IUPAC Name: 1-(2,4-dichlorophenyl)cyclopropane-1-carboxylic acid
SYSTEMATIC NAME: 1-(2,4-dichlorophenyl)cyclopropane-1-carboxylic acid
MOLECULAR FORMULA: C10H8Cl2O2
MOLECULAR WEIGHT: 231.07532
SMILES: C1CC1(C2=C(C=C(C=C2)Cl)Cl)C(=O)O
Structure:
CAS RN: 61906-75-0
CAS Name: (2S)-2-(4-amino-2-chloro-5-methylphenyl)-2-(4-chlorophenyl)acetonitrile
OPENEYE Name: (2S)-2-(4-amino-2-chloro-5-methyl-phenyl)-2-(4-chlorophenyl)acetonitrile
IUPAC Name: (2S)-2-(4-amino-2-chloro-5-methylphenyl)-2-(4-chlorophenyl)acetonitrile
SYSTEMATIC NAME: (2S)-2-(4-azanyl-2-chloranyl-5-methyl-phenyl)-2-(4-chlorophenyl)ethanenitrile
MOLECULAR FORMULA: C15H12Cl2N2
MOLECULAR WEIGHT: 291.17518
SMILES: CC1=CC(=C(C=C1N)Cl)[C@@H](C#N)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 61437-85-2
CAS Name: (2S)-2-(4-amino-2-chloro-5-methylphenyl)-2-(4-chlorophenyl)acetonitrile
OPENEYE Name: (2S)-2-(4-amino-2-chloro-5-methyl-phenyl)-2-(4-chlorophenyl)acetonitrile
IUPAC Name: (2S)-2-(4-amino-2-chloro-5-methylphenyl)-2-(4-chlorophenyl)acetonitrile
SYSTEMATIC NAME: (2S)-2-(4-azanyl-2-chloranyl-5-methyl-phenyl)-2-(4-chlorophenyl)ethanenitrile
MOLECULAR FORMULA: C15H12Cl2N2
MOLECULAR WEIGHT: 291.17518
SMILES: CC1=CC(=C(C=C1N)Cl)[C@@H](C#N)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 61437-85-2
CAS Name: (2R)-2-(4-amino-2-chloro-5-methylphenyl)-2-(4-chlorophenyl)acetonitrile
OPENEYE Name: (2R)-2-(4-amino-2-chloro-5-methyl-phenyl)-2-(4-chlorophenyl)acetonitrile
IUPAC Name: (2R)-2-(4-amino-2-chloro-5-methylphenyl)-2-(4-chlorophenyl)acetonitrile
SYSTEMATIC NAME: (2R)-2-(4-azanyl-2-chloranyl-5-methyl-phenyl)-2-(4-chlorophenyl)ethanenitrile
MOLECULAR FORMULA: C15H12Cl2N2
MOLECULAR WEIGHT: 291.17518
SMILES: CC1=CC(=C(C=C1N)Cl)[C@H](C#N)C2=CC=C(C=C2)Cl
Structure:
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