Monday, June 24, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2,2,3-trimethylpent-4-en-1-ol
CAS Name: 2,2,3-trimethyl-4-penten-1-ol
IUPAC NAME: 2,2,3-trimethylpent-4-en-1-ol
SYSTEMATIC NAME: 2,2,3-trimethylpent-4-en-1-ol
MOLECULAR FORMULA: C8H16O
MOLECULAR WEIGHT: 128.21204
SMILES: CC(C=C)C(C)(C)CO
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Product OPENEYE NAME: 1-tert-butylcyclohex-2-ene-1-carbaldehyde
CAS Name: 1-tert-butyl-1-cyclohex-2-enecarboxaldehyde
IUPAC NAME: 1-tert-butylcyclohex-2-ene-1-carbaldehyde
SYSTEMATIC NAME: 1-tert-butylcyclohex-2-ene-1-carbaldehyde
MOLECULAR FORMULA: C11H18O
MOLECULAR WEIGHT: 166.26002
SMILES: CC(C)(C)C1(CCCC=C1)C=O
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Product OPENEYE NAME: 1-(3-tert-butylcyclohex-3-en-1-yl)-2-methyl-propan-1-ol
CAS Name: 1-(3-tert-butyl-1-cyclohex-3-enyl)-2-methyl-1-propanol
IUPAC NAME: 1-(3-tert-butylcyclohex-3-en-1-yl)-2-methylpropan-1-ol
SYSTEMATIC NAME: 1-(3-tert-butylcyclohex-3-en-1-yl)-2-methyl-propan-1-ol
MOLECULAR FORMULA: C14H26O
MOLECULAR WEIGHT: 210.35564
SMILES: CC(C)C(C1CCC=C(C1)C(C)(C)C)O
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Product OPENEYE NAME: diisopropyl 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate
CAS Name: 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylic acid dipropan-2-yl ester
IUPAC NAME: dipropan-2-yl 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate
SYSTEMATIC NAME: dipropan-2-yl 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate
MOLECULAR FORMULA: C14H19NO6
MOLECULAR WEIGHT: 297.30376
SMILES: CC(C)OC(=O)C1=CC=CC(C1)(C(=O)OC(C)C)[N+](=O)[O-]
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Product OPENEYE NAME: 5-tert-butylcyclohex-2-ene-1-carbaldehyde
CAS Name: 5-tert-butyl-1-cyclohex-2-enecarboxaldehyde
IUPAC NAME: 5-tert-butylcyclohex-2-ene-1-carbaldehyde
SYSTEMATIC NAME: 5-tert-butylcyclohex-2-ene-1-carbaldehyde
MOLECULAR FORMULA: C11H18O
MOLECULAR WEIGHT: 166.26002
SMILES: CC(C)(C)C1CC=CC(C1)C=O
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Product OPENEYE NAME: 2-tert-butylcyclohexene-1-carbaldehyde
CAS Name: 2-tert-butyl-1-cyclohexenecarboxaldehyde
IUPAC NAME: 2-tert-butylcyclohexene-1-carbaldehyde
SYSTEMATIC NAME: 2-tert-butylcyclohexene-1-carbaldehyde
MOLECULAR FORMULA: C11H18O
MOLECULAR WEIGHT: 166.26002
SMILES: CC(C)(C)C1=C(CCCC1)C=O
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Product OPENEYE NAME: 1-(4-tert-butylcyclohex-3-en-1-yl)-2-methyl-propan-1-ol
CAS Name: 1-(4-tert-butyl-1-cyclohex-3-enyl)-2-methyl-1-propanol
IUPAC NAME: 1-(4-tert-butylcyclohex-3-en-1-yl)-2-methylpropan-1-ol
SYSTEMATIC NAME: 1-(4-tert-butylcyclohex-3-en-1-yl)-2-methyl-propan-1-ol
MOLECULAR FORMULA: C14H26O
MOLECULAR WEIGHT: 210.35564
SMILES: CC(C)C(C1CCC(=CC1)C(C)(C)C)O
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Product OPENEYE NAME: 1,2-dimethyl-3,5-diphenyl-pyrazolidin-1-ium; methyl sulfate
CAS Name: 1,2-dimethyl-3,5-diphenylpyrazolidin-1-ium; methyl sulfate
IUPAC NAME: 1,2-dimethyl-3,5-diphenylpyrazolidin-1-ium; methyl sulfate
SYSTEMATIC NAME: 1,2-dimethyl-3,5-diphenyl-pyrazolidin-1-ium; methyl sulfate
MOLECULAR FORMULA: C18H24N2O4S
MOLECULAR WEIGHT: 364.45916
SMILES: C[NH+]1C(CC(N1C)C2=CC=CC=C2)C3=CC=CC=C3.COS(=O)(=O)[O-]
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Product OPENEYE NAME: imidazo[1,2-b]pyridazine-8-carbaldehyde
CAS Name: 8-imidazo[1,2-b]pyridazinecarboxaldehyde
IUPAC NAME: imidazo[1,2-b]pyridazine-8-carbaldehyde
SYSTEMATIC NAME: imidazo[1,2-b]pyridazine-8-carbaldehyde
MOLECULAR FORMULA: C7H5N3O
MOLECULAR WEIGHT: 147.1341
SMILES: C1=CN2C(=N1)C(=CC=N2)C=O
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Product OPENEYE NAME: 2-(8-benzyloxy-2-methyl-imidazo[1,2-b]pyridazin-3-yl)acetonitrile
CAS Name: 2-(2-methyl-8-phenylmethoxy-3-imidazo[1,2-b]pyridazinyl)acetonitrile
IUPAC NAME: 2-(2-methyl-8-phenylmethoxyimidazo[1,2-b]pyridazin-3-yl)acetonitrile
SYSTEMATIC NAME: 2-(2-methyl-8-phenylmethoxy-imidazo[1,2-b]pyridazin-3-yl)ethanenitrile
MOLECULAR FORMULA: C16H14N4O
MOLECULAR WEIGHT: 278.30856
SMILES: CC1=C(N2C(=N1)C(=CC=N2)OCC3=CC=CC=C3)CC#N
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Product OPENEYE NAME: 2,3-dimethyl-8-[(E)-styryl]imidazo[1,2-b]pyridazine
CAS Name: 2,3-dimethyl-8-[(E)-2-phenylethenyl]imidazo[1,2-b]pyridazine
IUPAC NAME: 2,3-dimethyl-8-[(E)-2-phenylethenyl]imidazo[1,2-b]pyridazine
SYSTEMATIC NAME: 2,3-dimethyl-8-[(E)-2-phenylethenyl]imidazo[1,2-b]pyridazine
MOLECULAR FORMULA: C16H15N3
MOLECULAR WEIGHT: 249.3104
SMILES: CC1=C(N2C(=N1)C(=CC=N2)/C=C/C3=CC=CC=C3)C
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Product OPENEYE NAME: 8-benzyloxy-2,3-dimethyl-imidazo[1,2-b]pyridazine
CAS Name: 2,3-dimethyl-8-phenylmethoxyimidazo[1,2-b]pyridazine
IUPAC NAME: 2,3-dimethyl-8-phenylmethoxyimidazo[1,2-b]pyridazine
SYSTEMATIC NAME: 2,3-dimethyl-8-phenylmethoxy-imidazo[1,2-b]pyridazine
MOLECULAR FORMULA: C15H15N3O
MOLECULAR WEIGHT: 253.2991
SMILES: CC1=C(N2C(=N1)C(=CC=N2)OCC3=CC=CC=C3)C
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Product OPENEYE NAME: 8-benzyloxy-3-methyl-imidazo[1,2-b]pyridazin-2-amine
CAS Name: 3-methyl-8-phenylmethoxy-2-imidazo[1,2-b]pyridazinamine
IUPAC NAME: 3-methyl-8-phenylmethoxyimidazo[1,2-b]pyridazin-2-amine
SYSTEMATIC NAME: 3-methyl-8-phenylmethoxy-imidazo[1,2-b]pyridazin-2-amine
MOLECULAR FORMULA: C14H14N4O
MOLECULAR WEIGHT: 254.28716
SMILES: CC1=C(N=C2N1N=CC=C2OCC3=CC=CC=C3)N
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Product OPENEYE NAME: 8-benzyloxy-2-methyl-imidazo[1,2-b]pyridazin-3-amine
CAS Name: 2-methyl-8-phenylmethoxy-3-imidazo[1,2-b]pyridazinamine
IUPAC NAME: 2-methyl-8-phenylmethoxyimidazo[1,2-b]pyridazin-3-amine
SYSTEMATIC NAME: 2-methyl-8-phenylmethoxy-imidazo[1,2-b]pyridazin-3-amine
MOLECULAR FORMULA: C14H14N4O
MOLECULAR WEIGHT: 254.28716
SMILES: CC1=C(N2C(=N1)C(=CC=N2)OCC3=CC=CC=C3)N
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