Sunday, August 4, 2013

All Chemical Compounds Information




Product OPENEYE NAME: butyl 4-[(1E,3E)-2-methyl-4-(2,2,6-trimethylnorcaran-1-yl)buta-1,3-dienyl]benzoate
CAS Name: 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoic acid butyl ester
IUPAC NAME: butyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
SYSTEMATIC NAME: butyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
MOLECULAR FORMULA: C26H36O2
MOLECULAR WEIGHT: 380.56284
SMILES: CCCCOC(=O)C1=CC=C(C=C1)/C=C(\C)/C=C/C23CC2(CCCC3(C)C)C
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Product OPENEYE NAME: benzyl 4-[(1Z,3E)-2-methyl-4-(2,2,6-trimethylnorcaran-1-yl)buta-1,3-dienyl]benzoate
CAS Name: 4-[(1Z,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoic acid (phenylmethyl) ester
IUPAC NAME: benzyl 4-[(1Z,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
SYSTEMATIC NAME: (phenylmethyl) 4-[(1Z,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
MOLECULAR FORMULA: C29H34O2
MOLECULAR WEIGHT: 414.57906
SMILES: C/C(=C/C1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2)/C=C/C34CC3(CCCC4(C)C)C
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Product OPENEYE NAME: octyl 4-[(1E,3E)-2-methyl-4-(2,2,6-trimethylnorcaran-1-yl)buta-1,3-dienyl]benzoate
CAS Name: 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoic acid octyl ester
IUPAC NAME: octyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
SYSTEMATIC NAME: octyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
MOLECULAR FORMULA: C30H44O2
MOLECULAR WEIGHT: 436.66916
SMILES: CCCCCCCCOC(=O)C1=CC=C(C=C1)/C=C(\C)/C=C/C23CC2(CCCC3(C)C)C
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Product OPENEYE NAME: (2Z,4E)-3-methyl-5-(2,2,6-trimethylnorcaran-1-yl)penta-2,4-dien-1-ol
CAS Name: (2Z,4E)-3-methyl-5-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)-1-penta-2,4-dienol
IUPAC NAME: (2Z,4E)-3-methyl-5-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)penta-2,4-dien-1-ol
SYSTEMATIC NAME: (2Z,4E)-3-methyl-5-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)penta-2,4-dien-1-ol
MOLECULAR FORMULA: C16H26O
MOLECULAR WEIGHT: 234.37704
SMILES: C/C(=C/CO)/C=C/C12CC1(CCCC2(C)C)C
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Product OPENEYE NAME: heptyl 4-[(1E,3E)-2-methyl-4-(2,2,6-trimethylnorcaran-1-yl)buta-1,3-dienyl]benzoate
CAS Name: 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoic acid heptyl ester
IUPAC NAME: heptyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
SYSTEMATIC NAME: heptyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
MOLECULAR FORMULA: C29H42O2
MOLECULAR WEIGHT: 422.64258
SMILES: CCCCCCCOC(=O)C1=CC=C(C=C1)/C=C(\C)/C=C/C23CC2(CCCC3(C)C)C
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Product OPENEYE NAME: pentyl 4-[(1E,3E)-2-methyl-4-(2,2,6-trimethylnorcaran-1-yl)buta-1,3-dienyl]benzoate
CAS Name: 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoic acid pentyl ester
IUPAC NAME: pentyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
SYSTEMATIC NAME: pentyl 4-[(1E,3E)-2-methyl-4-(1,5,5-trimethyl-6-bicyclo[4.1.0]heptanyl)buta-1,3-dienyl]benzoate
MOLECULAR FORMULA: C27H38O2
MOLECULAR WEIGHT: 394.58942
SMILES: CCCCCOC(=O)C1=CC=C(C=C1)/C=C(\C)/C=C/C23CC2(CCCC3(C)C)C
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Product OPENEYE NAME: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethyl-phenyl)methylsulfanyl]-2-hydroxy-acetate
CAS Name: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methylthio]-2-hydroxyacetate
IUPAC NAME: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methylsulfanyl]-2-hydroxyacetate
SYSTEMATIC NAME: 2-[(4-tert-butyl-2,6-dimethyl-3-oxidanyl-phenyl)methylsulfanyl]-2-oxidanyl-ethanoate
MOLECULAR FORMULA: C15H21O4S-
MOLECULAR WEIGHT: 297.38984
SMILES: CC1=CC(=C(C(=C1CSC(C(=O)[O-])O)C)O)C(C)(C)C
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Product OPENEYE NAME: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethyl-phenyl)methylsulfanyl]-2-hydroxy-acetic acid
CAS Name: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methylthio]-2-hydroxyacetic acid
IUPAC NAME: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methylsulfanyl]-2-hydroxyacetic acid
SYSTEMATIC NAME: 2-[(4-tert-butyl-2,6-dimethyl-3-oxidanyl-phenyl)methylsulfanyl]-2-oxidanyl-ethanoic acid
MOLECULAR FORMULA: C15H22O4S
MOLECULAR WEIGHT: 298.39778
SMILES: CC1=CC(=C(C(=C1CSC(C(=O)O)O)C)O)C(C)(C)C
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Product OPENEYE NAME: methyl 2-sulfanyl-3-(3,4,5-tritert-butyl-5-hydroxy-cyclohexa-1,3-dien-1-yl)propanoate
CAS Name: 2-mercapto-3-(3,4,5-tritert-butyl-5-hydroxy-1-cyclohexa-1,3-dienyl)propanoic acid methyl ester
IUPAC NAME: methyl 2-sulfanyl-3-(3,4,5-tritert-butyl-5-hydroxycyclohexa-1,3-dien-1-yl)propanoate
SYSTEMATIC NAME: methyl 2-sulfanyl-3-(3,4,5-tritert-butyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl)propanoate
MOLECULAR FORMULA: C22H38O3S
MOLECULAR WEIGHT: 382.60032
SMILES: CC(C)(C)C1=C(C(CC(=C1)CC(C(=O)OC)S)(C(C)(C)C)O)C(C)(C)C
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Product OPENEYE NAME: 2-tert-butyl-4-(chloromethyl)-4,6-dimethyl-cyclohexa-2,5-dien-1-ol
CAS Name: 2-tert-butyl-4-(chloromethyl)-4,6-dimethyl-1-cyclohexa-2,5-dienol
IUPAC NAME: 2-tert-butyl-4-(chloromethyl)-4,6-dimethylcyclohexa-2,5-dien-1-ol
SYSTEMATIC NAME: 2-tert-butyl-4-(chloromethyl)-4,6-dimethyl-cyclohexa-2,5-dien-1-ol
MOLECULAR FORMULA: C13H21ClO
MOLECULAR WEIGHT: 228.75824
SMILES: CC1=CC(C=C(C1O)C(C)(C)C)(C)CCl
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Product OPENEYE NAME: 2-(2-sulfanylethylsulfanyl)ethyl 3-(4-tert-butyl-5-hydroxy-3,5-dimethyl-cyclohexa-1,3-dien-1-yl)-2-sulfanyl-propanoate
CAS Name: 3-(4-tert-butyl-5-hydroxy-3,5-dimethyl-1-cyclohexa-1,3-dienyl)-2-mercaptopropanoic acid 2-(2-mercaptoethylthio)ethyl ester
IUPAC NAME: 2-(2-sulfanylethylsulfanyl)ethyl 3-(4-tert-butyl-5-hydroxy-3,5-dimethylcyclohexa-1,3-dien-1-yl)-2-sulfanylpropanoate
SYSTEMATIC NAME: 2-(2-sulfanylethylsulfanyl)ethyl 3-(4-tert-butyl-3,5-dimethyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl)-2-sulfanyl-propanoate
MOLECULAR FORMULA: C19H32O3S3
MOLECULAR WEIGHT: 404.65058
SMILES: CC1=C(C(CC(=C1)CC(C(=O)OCCSCCS)S)(C)O)C(C)(C)C
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