Friday, April 26, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2,7-dimethyl-5-phenyl-1,4-oxazepine
CAS Name: 2,7-dimethyl-5-phenyl-1,4-oxazepine
IUPAC NAME: 2,7-dimethyl-5-phenyl-1,4-oxazepine
SYSTEMATIC NAME: 2,7-dimethyl-5-phenyl-1,4-oxazepine
MOLECULAR FORMULA: C13H13NO
MOLECULAR WEIGHT: 199.24842
SMILES: CC1=CC(=NC=C(O1)C)C2=CC=CC=C2
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Product OPENEYE NAME: 4-methyl-6-phenyl-pyridin-3-ol
CAS Name: 4-methyl-6-phenyl-3-pyridinol
IUPAC NAME: 4-methyl-6-phenylpyridin-3-ol
SYSTEMATIC NAME: 4-methyl-6-phenyl-pyridin-3-ol
MOLECULAR FORMULA: C12H11NO
MOLECULAR WEIGHT: 185.22184
SMILES: CC1=CC(=NC=C1O)C2=CC=CC=C2
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Product OPENEYE NAME: 6,7-dimethyl-4-phenyl-1,3-oxazepine
CAS Name: 6,7-dimethyl-4-phenyl-1,3-oxazepine
IUPAC NAME: 6,7-dimethyl-4-phenyl-1,3-oxazepine
SYSTEMATIC NAME: 6,7-dimethyl-4-phenyl-1,3-oxazepine
MOLECULAR FORMULA: C13H13NO
MOLECULAR WEIGHT: 199.24842
SMILES: CC1=C(OC=NC(=C1)C2=CC=CC=C2)C
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Product OPENEYE NAME: 2,3-dimethyl-5-phenyl-pyrrole-1-carbaldehyde
CAS Name: 2,3-dimethyl-5-phenyl-1-pyrrolecarboxaldehyde
IUPAC NAME: 2,3-dimethyl-5-phenylpyrrole-1-carbaldehyde
SYSTEMATIC NAME: 2,3-dimethyl-5-phenyl-pyrrole-1-carbaldehyde
MOLECULAR FORMULA: C13H13NO
MOLECULAR WEIGHT: 199.24842
SMILES: CC1=C(N(C(=C1)C2=CC=CC=C2)C=O)C
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Product OPENEYE NAME: 1-iodo-4-phenylsulfanyl-benzene
CAS Name: 1-iodo-4-(phenylthio)benzene
IUPAC NAME: 1-iodo-4-phenylsulfanylbenzene
SYSTEMATIC NAME: 1-iodanyl-4-phenylsulfanyl-benzene
MOLECULAR FORMULA: C12H9IS
MOLECULAR WEIGHT: 312.16933
SMILES: C1=CC=C(C=C1)SC2=CC=C(C=C2)I
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Product OPENEYE NAME: 1-fluoro-3-phenylsulfanyl-benzene
CAS Name: 1-fluoro-3-(phenylthio)benzene
IUPAC NAME: 1-fluoro-3-phenylsulfanylbenzene
SYSTEMATIC NAME: 1-fluoranyl-3-phenylsulfanyl-benzene
MOLECULAR FORMULA: C12H9FS
MOLECULAR WEIGHT: 204.263263
SMILES: C1=CC=C(C=C1)SC2=CC=CC(=C2)F
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Product OPENEYE NAME: 1,4-bis(benzenesulfonyl)benzene
CAS Name: 1,4-bis(benzenesulfonyl)benzene
IUPAC NAME: 1,4-bis(benzenesulfonyl)benzene
SYSTEMATIC NAME: 1,4-bis(phenylsulfonyl)benzene
MOLECULAR FORMULA: C18H14O4S2
MOLECULAR WEIGHT: 358.43136
SMILES: C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1,3-bis(benzenesulfonyl)benzene
CAS Name: 1,3-bis(benzenesulfonyl)benzene
IUPAC NAME: 1,3-bis(benzenesulfonyl)benzene
SYSTEMATIC NAME: 1,3-bis(phenylsulfonyl)benzene
MOLECULAR FORMULA: C18H14O4S2
MOLECULAR WEIGHT: 358.43136
SMILES: C1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: bis(2,4,6-trifluorophenyl)diazene
CAS Name: bis(2,4,6-trifluorophenyl)diazene
IUPAC NAME: bis(2,4,6-trifluorophenyl)diazene
SYSTEMATIC NAME: bis[2,4,6-tris(fluoranyl)phenyl]diazene
MOLECULAR FORMULA: C12H4F6N2
MOLECULAR WEIGHT: 290.163979
SMILES: C1=C(C=C(C(=C1F)N=NC2=C(C=C(C=C2F)F)F)F)F
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Product OPENEYE NAME: 4-hydroxy-3-methyl-tetrahydrofuran-2-one
CAS Name: 4-hydroxy-3-methyl-2-oxolanone
IUPAC NAME: 4-hydroxy-3-methyloxolan-2-one
SYSTEMATIC NAME: 3-methyl-4-oxidanyl-oxolan-2-one
MOLECULAR FORMULA: C5H8O3
MOLECULAR WEIGHT: 116.11522
SMILES: CC1C(COC1=O)O
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Product OPENEYE NAME: 3-hydroxy-4-methyl-tetrahydrofuran-2-one
CAS Name: 3-hydroxy-4-methyl-2-oxolanone
IUPAC NAME: 3-hydroxy-4-methyloxolan-2-one
SYSTEMATIC NAME: 4-methyl-3-oxidanyl-oxolan-2-one
MOLECULAR FORMULA: C5H8O3
MOLECULAR WEIGHT: 116.11522
SMILES: CC1COC(=O)C1O
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Product OPENEYE NAME: 2-oxo-2-(N-(2-oxo-1,2-diphenyl-ethyl)anilino)acetyl chloride
CAS Name: 2-oxo-2-(N-(2-oxo-1,2-diphenylethyl)anilino)acetyl chloride
IUPAC NAME: 2-oxo-2-(N-(2-oxo-1,2-diphenylethyl)anilino)acetyl chloride
SYSTEMATIC NAME: 2-oxidanylidene-2-[(2-oxidanylidene-1,2-diphenyl-ethyl)-phenyl-amino]ethanoyl chloride
MOLECULAR FORMULA: C22H16ClNO3
MOLECULAR WEIGHT: 377.82034
SMILES: C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)N(C3=CC=CC=C3)C(=O)C(=O)Cl
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Product OPENEYE NAME: 1-benzyl-3-methyl-imidazolidine
CAS Name: 1-methyl-3-(phenylmethyl)imidazolidine
IUPAC NAME: 1-benzyl-3-methylimidazolidine
SYSTEMATIC NAME: 1-methyl-3-(phenylmethyl)imidazolidine
MOLECULAR FORMULA: C11H16N2
MOLECULAR WEIGHT: 176.25814
SMILES: CN1CCN(C1)CC2=CC=CC=C2
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Product OPENEYE NAME: 1-ethyl-3-methyl-imidazolidine
CAS Name: 1-ethyl-3-methylimidazolidine
IUPAC NAME: 1-ethyl-3-methylimidazolidine
SYSTEMATIC NAME: 1-ethyl-3-methyl-imidazolidine
MOLECULAR FORMULA: C6H14N2
MOLECULAR WEIGHT: 114.18876
SMILES: CCN1CCN(C1)C
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Product OPENEYE NAME: 2-iodopentanal
CAS Name: 2-iodopentanal
IUPAC NAME: 2-iodopentanal
SYSTEMATIC NAME: 2-iodanylpentanal
MOLECULAR FORMULA: C5H9IO
MOLECULAR WEIGHT: 212.02883
SMILES: CCCC(C=O)I
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Product OPENEYE NAME: 2-methoxy-6-(1-methyl-3-phenyl-prop-2-ynyl)naphthalene
CAS Name: 2-methoxy-6-(4-phenylbut-3-yn-2-yl)naphthalene
IUPAC NAME: 2-methoxy-6-(4-phenylbut-3-yn-2-yl)naphthalene
SYSTEMATIC NAME: 2-methoxy-6-(4-phenylbut-3-yn-2-yl)naphthalene
MOLECULAR FORMULA: C21H18O
MOLECULAR WEIGHT: 286.36702
SMILES: CC(C#CC1=CC=CC=C1)C2=CC3=C(C=C2)C=C(C=C3)OC
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