Product OPENEYE NAME: N-(5-methyl-1-oxo-2H-isoquinolin-6-yl)acetamide
CAS Name: N-(5-methyl-1-oxo-2H-isoquinolin-6-yl)acetamide
IUPAC NAME: N-(5-methyl-1-oxo-2H-isoquinolin-6-yl)acetamide
SYSTEMATIC NAME: N-(5-methyl-1-oxidanylidene-2H-isoquinolin-6-yl)ethanamide
MOLECULAR FORMULA: C12H12N2O2
MOLECULAR WEIGHT: 216.23588
SMILES: CC1=C(C=CC2=C1C=CNC2=O)NC(=O)C
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Product OPENEYE NAME: 6-amino-5-methyl-4H-isoquinolin-1-one
CAS Name: 6-amino-5-methyl-4H-isoquinolin-1-one
IUPAC NAME: 6-amino-5-methyl-4H-isoquinolin-1-one
SYSTEMATIC NAME: 6-azanyl-5-methyl-4H-isoquinolin-1-one
MOLECULAR FORMULA: C10H10N2O
MOLECULAR WEIGHT: 174.1992
SMILES: CC1=C(C=CC2=C1CC=NC2=O)N
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Product OPENEYE NAME: N2-(5,8-dimethyl-6-isoquinolyl)pyridine-2,3-diamine
CAS Name: N2-(5,8-dimethyl-6-isoquinolinyl)pyridine-2,3-diamine
IUPAC NAME: 2-N-(5,8-dimethylisoquinolin-6-yl)pyridine-2,3-diamine
SYSTEMATIC NAME: N2-(5,8-dimethylisoquinolin-6-yl)pyridine-2,3-diamine
MOLECULAR FORMULA: C16H16N4
MOLECULAR WEIGHT: 264.32504
SMILES: CC1=CC(=C(C2=C1C=NC=C2)C)NC3=C(C=CC=N3)N
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Product OPENEYE NAME: N-(3-formyl-2-methyl-phenyl)acetamide
CAS Name: N-(3-formyl-2-methylphenyl)acetamide
IUPAC NAME: N-(3-formyl-2-methylphenyl)acetamide
SYSTEMATIC NAME: N-(3-methanoyl-2-methyl-phenyl)ethanamide
MOLECULAR FORMULA: C10H11NO2
MOLECULAR WEIGHT: 177.19984
SMILES: CC1=C(C=CC=C1NC(=O)C)C=O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H27N5
MOLECULAR WEIGHT: 361.48328
SMILES: CCN(CC)CCCNC1=NC=CC2=C1C3=C(N2C)C=C4C=CN=CC4=C3
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Product OPENEYE NAME: (E)-3-(3-acetamido-2-methyl-phenyl)prop-2-enoic acid
CAS Name: (E)-3-(3-acetamido-2-methylphenyl)-2-propenoic acid
IUPAC NAME: (E)-3-(3-acetamido-2-methylphenyl)prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-(3-acetamido-2-methyl-phenyl)prop-2-enoic acid
MOLECULAR FORMULA: C12H13NO3
MOLECULAR WEIGHT: 219.23652
SMILES: CC1=C(C=CC=C1NC(=O)C)/C=C/C(=O)O
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Product OPENEYE NAME: 3-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile
CAS Name: 3-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile
IUPAC NAME: 3-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile
SYSTEMATIC NAME: 3-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile
MOLECULAR FORMULA: C20H21FN2O
MOLECULAR WEIGHT: 324.391943
SMILES: CN(C)CCCC1C2=C(C=CC(=C2)C#N)C(O1)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 1-[phenyl-[phenyl-[4-(trifluoromethyl)phenyl]methoxy]methyl]-4-(trifluoromethyl)benzene
CAS Name: 1-[phenyl-[phenyl-[4-(trifluoromethyl)phenyl]methoxy]methyl]-4-(trifluoromethyl)benzene
IUPAC NAME: 1-[phenyl-[phenyl-[4-(trifluoromethyl)phenyl]methoxy]methyl]-4-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1-[phenyl-[phenyl-[4-(trifluoromethyl)phenyl]methoxy]methyl]-4-(trifluoromethyl)benzene
MOLECULAR FORMULA: C28H20F6O
MOLECULAR WEIGHT: 486.448219
SMILES: C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(F)(F)F)OC(C3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F
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Product OPENEYE NAME: 5-phenyl-2-azabicyclo[3.2.2]nonane
CAS Name: 5-phenyl-2-azabicyclo[3.2.2]nonane
IUPAC NAME: 5-phenyl-2-azabicyclo[3.2.2]nonane
SYSTEMATIC NAME: 5-phenyl-2-azabicyclo[3.2.2]nonane
MOLECULAR FORMULA: C14H19N
MOLECULAR WEIGHT: 201.30736
SMILES: C1CC2(CCC1NCC2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(4-methoxyphenoxy)-1,3-dimethyl-4-phenyl-piperidine
CAS Name: 2-(4-methoxyphenoxy)-1,3-dimethyl-4-phenylpiperidine
IUPAC NAME: 2-(4-methoxyphenoxy)-1,3-dimethyl-4-phenylpiperidine
SYSTEMATIC NAME: 2-(4-methoxyphenoxy)-1,3-dimethyl-4-phenyl-piperidine
MOLECULAR FORMULA: C20H25NO2
MOLECULAR WEIGHT: 311.418
SMILES: CC1C(CCN(C1OC2=CC=C(C=C2)OC)C)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl 3-[4-(2-methyl-2-phenyl-propoxy)phenyl]-2-methylsulfonyloxy-propanoate
CAS Name: 3-[4-(2-methyl-2-phenylpropoxy)phenyl]-2-methylsulfonyloxypropanoic acid ethyl ester
IUPAC NAME: ethyl 3-[4-(2-methyl-2-phenylpropoxy)phenyl]-2-methylsulfonyloxypropanoate
SYSTEMATIC NAME: ethyl 3-[4-(2-methyl-2-phenyl-propoxy)phenyl]-2-methylsulfonyloxy-propanoate
MOLECULAR FORMULA: C22H28O6S
MOLECULAR WEIGHT: 420.51912
SMILES: CCOC(=O)C(CC1=CC=C(C=C1)OCC(C)(C)C2=CC=CC=C2)OS(=O)(=O)C
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Product OPENEYE NAME: ethyl 3-[4-[(1-methylcyclohexyl)methoxy]phenyl]-2-methylsulfonyloxy-propanoate
CAS Name: 3-[4-[(1-methylcyclohexyl)methoxy]phenyl]-2-methylsulfonyloxypropanoic acid ethyl ester
IUPAC NAME: ethyl 3-[4-[(1-methylcyclohexyl)methoxy]phenyl]-2-methylsulfonyloxypropanoate
SYSTEMATIC NAME: ethyl 3-[4-[(1-methylcyclohexyl)methoxy]phenyl]-2-methylsulfonyloxy-propanoate
MOLECULAR FORMULA: C20H30O6S
MOLECULAR WEIGHT: 398.5136
SMILES: CCOC(=O)C(CC1=CC=C(C=C1)OCC2(CCCCC2)C)OS(=O)(=O)C
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Product OPENEYE NAME: 2-bromo-3-[4-[(4-chlorophenyl)methoxy]phenyl]propanoic acid
CAS Name: 2-bromo-3-[4-[(4-chlorophenyl)methoxy]phenyl]propanoic acid
IUPAC NAME: 2-bromo-3-[4-[(4-chlorophenyl)methoxy]phenyl]propanoic acid
SYSTEMATIC NAME: 2-bromanyl-3-[4-[(4-chlorophenyl)methoxy]phenyl]propanoic acid
MOLECULAR FORMULA: C16H14BrClO3
MOLECULAR WEIGHT: 369.63756
SMILES: C1=CC(=CC=C1CC(C(=O)O)Br)OCC2=CC=C(C=C2)Cl
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