Tuesday, April 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 5,8-dimethyl-2-oxido-phthalazin-2-ium
CAS Name: 5,8-dimethyl-2-oxidophthalazin-2-ium
IUPAC NAME: 5,8-dimethyl-2-oxidophthalazin-2-ium
SYSTEMATIC NAME: 5,8-dimethyl-2-oxidanidyl-phthalazin-2-ium
MOLECULAR FORMULA: C10H10N2O
MOLECULAR WEIGHT: 174.1992
SMILES: CC1=C2C=N[N+](=CC2=C(C=C1)C)[O-]
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Product OPENEYE NAME: 5,6,8-trimethylphthalazine
CAS Name: 5,6,8-trimethylphthalazine
IUPAC NAME: 5,6,8-trimethylphthalazine
SYSTEMATIC NAME: 5,6,8-trimethylphthalazine
MOLECULAR FORMULA: C11H12N2
MOLECULAR WEIGHT: 172.22638
SMILES: CC1=CC(=C(C2=CN=NC=C12)C)C
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Product OPENEYE NAME: 5,6,7,8-tetramethylphthalazine
CAS Name: 5,6,7,8-tetramethylphthalazine
IUPAC NAME: 5,6,7,8-tetramethylphthalazine
SYSTEMATIC NAME: 5,6,7,8-tetramethylphthalazine
MOLECULAR FORMULA: C12H14N2
MOLECULAR WEIGHT: 186.25296
SMILES: CC1=C(C2=CN=NC=C2C(=C1C)C)C
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Product OPENEYE NAME: 5-fluorophthalazine
CAS Name: 5-fluorophthalazine
IUPAC NAME: 5-fluorophthalazine
SYSTEMATIC NAME: 5-fluoranylphthalazine
MOLECULAR FORMULA: C8H5FN2
MOLECULAR WEIGHT: 148.137103
SMILES: C1=CC2=CN=NC=C2C(=C1)F
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Product OPENEYE NAME: 5-(5-bromo-2,3-dihydrobenzofuran-2-yl)-1H-imidazole
CAS Name: 5-(5-bromo-2,3-dihydrobenzofuran-2-yl)-1H-imidazole
IUPAC NAME: 5-(5-bromo-2,3-dihydro-1-benzofuran-2-yl)-1H-imidazole
SYSTEMATIC NAME: 5-(5-bromanyl-2,3-dihydro-1-benzofuran-2-yl)-1H-imidazole
MOLECULAR FORMULA: C11H9BrN2O
MOLECULAR WEIGHT: 265.10596
SMILES: C1C(OC2=C1C=C(C=C2)Br)C3=CN=CN3
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Product OPENEYE NAME: 5-(5-bromo-2,3-dihydrobenzofuran-2-yl)-1H-imidazole hydrochloride
CAS Name: 5-(5-bromo-2,3-dihydrobenzofuran-2-yl)-1H-imidazole hydrochloride
IUPAC NAME: 5-(5-bromo-2,3-dihydro-1-benzofuran-2-yl)-1H-imidazole hydrochloride
SYSTEMATIC NAME: 5-(5-bromanyl-2,3-dihydro-1-benzofuran-2-yl)-1H-imidazole hydrochloride
MOLECULAR FORMULA: C11H10BrClN2O
MOLECULAR WEIGHT: 301.5669
SMILES: C1C(OC2=C1C=C(C=C2)Br)C3=CN=CN3.Cl
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Product OPENEYE NAME: 3,5-dimethyl-1H-indene-2-carboxylic acid
CAS Name: 3,5-dimethyl-1H-indene-2-carboxylic acid
IUPAC NAME: 3,5-dimethyl-1H-indene-2-carboxylic acid
SYSTEMATIC NAME: 3,5-dimethyl-1H-indene-2-carboxylic acid
MOLECULAR FORMULA: C12H12O2
MOLECULAR WEIGHT: 188.22248
SMILES: CC1=CC2=C(CC(=C2C)C(=O)O)C=C1
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Product OPENEYE NAME: 3,7-dimethyl-1H-indene-2-carboxylic acid
CAS Name: 3,7-dimethyl-1H-indene-2-carboxylic acid
IUPAC NAME: 3,7-dimethyl-1H-indene-2-carboxylic acid
SYSTEMATIC NAME: 3,7-dimethyl-1H-indene-2-carboxylic acid
MOLECULAR FORMULA: C12H12O2
MOLECULAR WEIGHT: 188.22248
SMILES: CC1=CC=CC2=C1CC(=C2C)C(=O)O
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Product OPENEYE NAME: 1,4-dimethylindane-2-carboxylic acid
CAS Name: 1,4-dimethyl-2,3-dihydro-1H-indene-2-carboxylic acid
IUPAC NAME: 1,4-dimethyl-2,3-dihydro-1H-indene-2-carboxylic acid
SYSTEMATIC NAME: 1,4-dimethyl-2,3-dihydro-1H-indene-2-carboxylic acid
MOLECULAR FORMULA: C12H14O2
MOLECULAR WEIGHT: 190.23836
SMILES: CC1C(CC2=C1C=CC=C2C)C(=O)O
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Product OPENEYE NAME: 1-(1,4-dimethylindan-2-yl)ethanone
CAS Name: 1-(1,4-dimethyl-2,3-dihydro-1H-inden-2-yl)ethanone
IUPAC NAME: 1-(1,4-dimethyl-2,3-dihydro-1H-inden-2-yl)ethanone
SYSTEMATIC NAME: 1-(1,4-dimethyl-2,3-dihydro-1H-inden-2-yl)ethanone
MOLECULAR FORMULA: C13H16O
MOLECULAR WEIGHT: 188.26554
SMILES: CC1C(CC2=C1C=CC=C2C)C(=O)C
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Product OPENEYE NAME: 5-(2-methylindan-2-yl)-1H-imidazole
CAS Name: 5-(2-methyl-1,3-dihydroinden-2-yl)-1H-imidazole
IUPAC NAME: 5-(2-methyl-1,3-dihydroinden-2-yl)-1H-imidazole
SYSTEMATIC NAME: 5-(2-methyl-1,3-dihydroinden-2-yl)-1H-imidazole
MOLECULAR FORMULA: C13H14N2
MOLECULAR WEIGHT: 198.26366
SMILES: CC1(CC2=CC=CC=C2C1)C3=CN=CN3
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Product OPENEYE NAME: 5-indan-2-yl-1H-imidazole
CAS Name: 5-(2,3-dihydro-1H-inden-2-yl)-1H-imidazole
IUPAC NAME: 5-(2,3-dihydro-1H-inden-2-yl)-1H-imidazole
SYSTEMATIC NAME: 5-(2,3-dihydro-1H-inden-2-yl)-1H-imidazole
MOLECULAR FORMULA: C12H12N2
MOLECULAR WEIGHT: 184.23708
SMILES: C1C(CC2=CC=CC=C21)C3=CN=CN3
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Product OPENEYE NAME: 5-indan-2-yl-1H-imidazole hydrochloride
CAS Name: 5-(2,3-dihydro-1H-inden-2-yl)-1H-imidazole hydrochloride
IUPAC NAME: 5-(2,3-dihydro-1H-inden-2-yl)-1H-imidazole hydrochloride
SYSTEMATIC NAME: 5-(2,3-dihydro-1H-inden-2-yl)-1H-imidazole hydrochloride
MOLECULAR FORMULA: C12H13ClN2
MOLECULAR WEIGHT: 220.69802
SMILES: C1C(CC2=CC=CC=C21)C3=CN=CN3.Cl
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Product OPENEYE NAME: 5-(2-ethylindan-2-yl)-1H-imidazole hydrochloride
CAS Name: 5-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole hydrochloride
IUPAC NAME: 5-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole hydrochloride
SYSTEMATIC NAME: 5-(2-ethyl-1,3-dihydroinden-2-yl)-1H-imidazole hydrochloride
MOLECULAR FORMULA: C14H17ClN2
MOLECULAR WEIGHT: 248.75118
SMILES: CCC1(CC2=CC=CC=C2C1)C3=CN=CN3.Cl
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Product OPENEYE NAME: 2-[(4-imidazo[1,5-a]pyridin-5-ylphenyl)methyl]prop-2-enoic acid
CAS Name: 2-[[4-(5-imidazo[1,5-a]pyridinyl)phenyl]methyl]-2-propenoic acid
IUPAC NAME: 2-[(4-imidazo[1,5-a]pyridin-5-ylphenyl)methyl]prop-2-enoic acid
SYSTEMATIC NAME: 2-[(4-imidazo[1,5-a]pyridin-5-ylphenyl)methyl]prop-2-enoic acid
MOLECULAR FORMULA: C17H14N2O2
MOLECULAR WEIGHT: 278.30526
SMILES: C=C(CC1=CC=C(C=C1)C2=CC=CC3=CN=CN32)C(=O)O
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Product OPENEYE NAME: (2E,4E)-10-imidazo[1,5-a]pyridin-5-yldeca-2,4-dienoic acid
CAS Name: (2E,4E)-10-(5-imidazo[1,5-a]pyridinyl)deca-2,4-dienoic acid
IUPAC NAME: (2E,4E)-10-imidazo[1,5-a]pyridin-5-yldeca-2,4-dienoic acid
SYSTEMATIC NAME: (2E,4E)-10-imidazo[1,5-a]pyridin-5-yldeca-2,4-dienoic acid
MOLECULAR FORMULA: C17H20N2O2
MOLECULAR WEIGHT: 284.3529
SMILES: C1=CC2=CN=CN2C(=C1)CCCCC/C=C/C=C/C(=O)O
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Product OPENEYE NAME: ethyl 4-imidazo[1,5-a]pyridin-5-ylbenzoate
CAS Name: 4-(5-imidazo[1,5-a]pyridinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 4-imidazo[1,5-a]pyridin-5-ylbenzoate
SYSTEMATIC NAME: ethyl 4-imidazo[1,5-a]pyridin-5-ylbenzoate
MOLECULAR FORMULA: C16H14N2O2
MOLECULAR WEIGHT: 266.29456
SMILES: CCOC(=O)C1=CC=C(C=C1)C2=CC=CC3=CN=CN32
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Product OPENEYE NAME: (4-imidazo[1,5-a]pyridin-5-ylphenyl)methanol
CAS Name: [4-(5-imidazo[1,5-a]pyridinyl)phenyl]methanol
IUPAC NAME: (4-imidazo[1,5-a]pyridin-5-ylphenyl)methanol
SYSTEMATIC NAME: (4-imidazo[1,5-a]pyridin-5-ylphenyl)methanol
MOLECULAR FORMULA: C14H12N2O
MOLECULAR WEIGHT: 224.25788
SMILES: C1=CC2=CN=CN2C(=C1)C3=CC=C(C=C3)CO
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