Monday, August 8, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 1,3,5-triphenylbenzene
CAS Name: 1,3,5-triphenylbenzene
IUPAC NAME: 1,3,5-triphenylbenzene
SYSTEMATIC NAME: 1,3,5-triphenylbenzene
MOLECULAR FORMULA: C24H18
MOLECULAR WEIGHT: 306.39972
SMILES: C1=CC=C(C=C1)C2=CC(=CC(=C2)C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 1-methyl-3-(m-tolyl)benzene
CAS Name: 1-methyl-3-(3-methylphenyl)benzene
IUPAC NAME: 1-methyl-3-(3-methylphenyl)benzene
SYSTEMATIC NAME: 1-methyl-3-(3-methylphenyl)benzene
MOLECULAR FORMULA: C14H14
MOLECULAR WEIGHT: 182.26096
SMILES: CC1=CC=CC(=C1)C2=CC(=CC=C2)C
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Product OPENEYE NAME: [4-(4-azaniumyl-3-methyl-phenyl)-2-methyl-phenyl]ammonium dichloride
CAS Name: [4-(4-ammonio-3-methylphenyl)-2-methylphenyl]ammonium dichloride
IUPAC NAME: [4-(4-azaniumyl-3-methylphenyl)-2-methylphenyl]azanium dichloride
SYSTEMATIC NAME: [4-(4-azaniumyl-3-methyl-phenyl)-2-methyl-phenyl]azanium dichloride
MOLECULAR FORMULA: C14H18Cl2N2
MOLECULAR WEIGHT: 285.21212
SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)[NH3+])C)[NH3+].[Cl-].[Cl-]
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Product OPENEYE NAME: 4-(4-amino-3-chloro-phenyl)-2-chloro-aniline dihydrochloride
CAS Name: 4-(4-amino-3-chlorophenyl)-2-chloroaniline dihydrochloride
IUPAC NAME: 4-(4-amino-3-chlorophenyl)-2-chloroaniline dihydrochloride
SYSTEMATIC NAME: 4-(4-azanyl-3-chloranyl-phenyl)-2-chloranyl-aniline dihydrochloride
MOLECULAR FORMULA: C12H12Cl4N2
MOLECULAR WEIGHT: 326.04908
SMILES: C1=CC(=C(C=C1C2=CC(=C(C=C2)N)Cl)Cl)N.Cl.Cl
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Product OPENEYE NAME: 2-phenylnaphthalene
CAS Name: 2-phenylnaphthalene
IUPAC NAME: 2-phenylnaphthalene
SYSTEMATIC NAME: 2-phenylnaphthalene
MOLECULAR FORMULA: C16H12
MOLECULAR WEIGHT: 204.26648
SMILES: C1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: N-benzyl-N-phenyl-nitrous amide
CAS Name: N-phenyl-N-(phenylmethyl)nitrous amide
IUPAC NAME: N-benzyl-N-phenylnitrous amide
SYSTEMATIC NAME: N-phenyl-N-(phenylmethyl)nitrous amide
MOLECULAR FORMULA: C13H12N2O
MOLECULAR WEIGHT: 212.24718
SMILES: C1=CC=C(C=C1)CN(C2=CC=CC=C2)N=O
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Product OPENEYE NAME: 2-methylanthracene
CAS Name: 2-methylanthracene
IUPAC NAME: 2-methylanthracene
SYSTEMATIC NAME: 2-methylanthracene
MOLECULAR FORMULA: C15H12
MOLECULAR WEIGHT: 192.25578
SMILES: CC1=CC2=CC3=CC=CC=C3C=C2C=C1
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Product OPENEYE NAME: anthracen-2-amine
CAS Name: 2-anthracenamine
IUPAC NAME: anthracen-2-amine
SYSTEMATIC NAME: anthracen-2-amine
MOLECULAR FORMULA: C14H11N
MOLECULAR WEIGHT: 193.24384
SMILES: C1=CC=C2C=C3C=C(C=CC3=CC2=C1)N
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Product OPENEYE NAME: 2-methylacridine
CAS Name: 2-methylacridine
IUPAC NAME: 2-methylacridine
SYSTEMATIC NAME: 2-methylacridine
MOLECULAR FORMULA: C14H11N
MOLECULAR WEIGHT: 193.24384
SMILES: CC1=CC2=CC3=CC=CC=C3N=C2C=C1
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Product OPENEYE NAME: 2,6-dimethylanthracene
CAS Name: 2,6-dimethylanthracene
IUPAC NAME: 2,6-dimethylanthracene
SYSTEMATIC NAME: 2,6-dimethylanthracene
MOLECULAR FORMULA: C16H14
MOLECULAR WEIGHT: 206.28236
SMILES: CC1=CC2=CC3=C(C=C(C=C3)C)C=C2C=C1
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Product OPENEYE NAME: 9,10-dihydroanthracene
CAS Name: 9,10-dihydroanthracene
IUPAC NAME: 9,10-dihydroanthracene
SYSTEMATIC NAME: 9,10-dihydroanthracene
MOLECULAR FORMULA: C14H12
MOLECULAR WEIGHT: 180.24508
SMILES: C1C2=CC=CC=C2CC3=CC=CC=C31
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Product OPENEYE NAME: 1-methyl-4-(p-tolyl)benzene
CAS Name: 1-methyl-4-(4-methylphenyl)benzene
IUPAC NAME: 1-methyl-4-(4-methylphenyl)benzene
SYSTEMATIC NAME: 1-methyl-4-(4-methylphenyl)benzene
MOLECULAR FORMULA: C14H14
MOLECULAR WEIGHT: 182.26096
SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)C
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Product OPENEYE NAME: N-[4-(4-acetamidophenyl)phenyl]acetamide
CAS Name: N-[4-(4-acetamidophenyl)phenyl]acetamide
IUPAC NAME: N-[4-(4-acetamidophenyl)phenyl]acetamide
SYSTEMATIC NAME: N-[4-(4-acetamidophenyl)phenyl]ethanamide
MOLECULAR FORMULA: C16H16N2O2
MOLECULAR WEIGHT: 268.31044
SMILES: CC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C
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Product OPENEYE NAME: 1-methoxy-4-phenyl-benzene
CAS Name: 1-methoxy-4-phenylbenzene
IUPAC NAME: 1-methoxy-4-phenylbenzene
SYSTEMATIC NAME: 1-methoxy-4-phenyl-benzene
MOLECULAR FORMULA: C13H12O
MOLECULAR WEIGHT: 184.23378
SMILES: COC1=CC=C(C=C1)C2=CC=CC=C2
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Product OPENEYE NAME: naphthalene-2-carbonitrile
CAS Name: 2-naphthalenecarbonitrile
IUPAC NAME: naphthalene-2-carbonitrile
SYSTEMATIC NAME: naphthalene-2-carbonitrile
MOLECULAR FORMULA: C11H7N
MOLECULAR WEIGHT: 153.17998
SMILES: C1=CC=C2C=C(C=CC2=C1)C#N
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Product OPENEYE NAME: 6-nitroquinoline
CAS Name: 6-nitroquinoline
IUPAC NAME: 6-nitroquinoline
SYSTEMATIC NAME: 6-nitroquinoline
MOLECULAR FORMULA: C9H6N2O2
MOLECULAR WEIGHT: 174.15614
SMILES: C1=CC2=C(C=CC(=C2)[N+](=O)[O-])N=C1
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Product OPENEYE NAME: 7-nitroquinoline
CAS Name: 7-nitroquinoline
IUPAC NAME: 7-nitroquinoline
SYSTEMATIC NAME: 7-nitroquinoline
MOLECULAR FORMULA: C9H6N2O2
MOLECULAR WEIGHT: 174.15614
SMILES: C1=CC2=C(C=C(C=C2)[N+](=O)[O-])N=C1
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Product OPENEYE NAME: bis(2-methoxyphenyl)diazene
CAS Name: bis(2-methoxyphenyl)diazene
IUPAC NAME: bis(2-methoxyphenyl)diazene
SYSTEMATIC NAME: bis(2-methoxyphenyl)diazene
MOLECULAR FORMULA: C14H14N2O2
MOLECULAR WEIGHT: 242.27316
SMILES: COC1=CC=CC=C1N=NC2=CC=CC=C2OC
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Product OPENEYE NAME: 2-benzylnaphthalene
CAS Name: 2-(phenylmethyl)naphthalene
IUPAC NAME: 2-benzylnaphthalene
SYSTEMATIC NAME: 2-(phenylmethyl)naphthalene
MOLECULAR FORMULA: C17H14
MOLECULAR WEIGHT: 218.29306
SMILES: C1=CC=C(C=C1)CC2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: N,N-dimethyl-4-(2-naphthylazo)aniline
CAS Name: N,N-dimethyl-4-(2-naphthalenylazo)aniline
IUPAC NAME: N,N-dimethyl-4-(naphthalen-2-yldiazenyl)aniline
SYSTEMATIC NAME: N,N-dimethyl-4-(naphthalen-2-yldiazenyl)aniline
MOLECULAR FORMULA: C18H17N3
MOLECULAR WEIGHT: 275.34768
SMILES: CN(C)C1=CC=C(C=C1)N=NC2=CC3=CC=CC=C3C=C2
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