Saturday, June 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[4-(chloromethyl)phenyl]sulfanyl-2-methyl-propanoic acid
CAS Name: 2-[[4-(chloromethyl)phenyl]thio]-2-methylpropanoic acid
IUPAC NAME: 2-[4-(chloromethyl)phenyl]sulfanyl-2-methylpropanoic acid
SYSTEMATIC NAME: 2-[4-(chloromethyl)phenyl]sulfanyl-2-methyl-propanoic acid
MOLECULAR FORMULA: C11H13ClO2S
MOLECULAR WEIGHT: 244.73772
SMILES: CC(C)(C(=O)O)SC1=CC=C(C=C1)CCl
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Product OPENEYE NAME: ethyl 2-[4-[(3-benzoyl-2H-imidazol-1-yl)methyl]phenoxy]-2-methyl-propanoate bromide
CAS Name: 2-[4-[(3-benzoyl-2H-imidazol-1-yl)methyl]phenoxy]-2-methylpropanoic acid ethyl ester bromide
IUPAC NAME: ethyl 2-[4-[(3-benzoyl-2H-imidazol-1-yl)methyl]phenoxy]-2-methylpropanoate bromide
SYSTEMATIC NAME: ethyl 2-methyl-2-[4-[[3-(phenylcarbonyl)-2H-imidazol-1-yl]methyl]phenoxy]propanoate bromide
MOLECULAR FORMULA: C23H26BrN2O4-
MOLECULAR WEIGHT: 474.36754
SMILES: CCOC(=O)C(C)(C)OC1=CC=C(C=C1)CN2CN(C=C2)C(=O)C3=CC=CC=C3.[Br-]
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Product OPENEYE NAME: ethyl 2-[4-[(3-benzoyl-2H-imidazol-1-yl)methyl]phenoxy]-2-methyl-propanoate
CAS Name: 2-[4-[(3-benzoyl-2H-imidazol-1-yl)methyl]phenoxy]-2-methylpropanoic acid ethyl ester
IUPAC NAME: ethyl 2-[4-[(3-benzoyl-2H-imidazol-1-yl)methyl]phenoxy]-2-methylpropanoate
SYSTEMATIC NAME: ethyl 2-methyl-2-[4-[[3-(phenylcarbonyl)-2H-imidazol-1-yl]methyl]phenoxy]propanoate
MOLECULAR FORMULA: C23H26N2O4
MOLECULAR WEIGHT: 394.46354
SMILES: CCOC(=O)C(C)(C)OC1=CC=C(C=C1)CN2CN(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 3-[4-[2-(p-tolylsulfonyloxy)ethoxy]phenyl]propanoic acid
CAS Name: 3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]propanoic acid
IUPAC NAME: 3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]propanoic acid
SYSTEMATIC NAME: 3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]propanoic acid
MOLECULAR FORMULA: C18H20O6S
MOLECULAR WEIGHT: 364.4128
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)CCC(=O)O
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Product OPENEYE NAME: 2-[4-(iodomethyl)phenoxy]-2-methoxy-acetic acid
CAS Name: 2-[4-(iodomethyl)phenoxy]-2-methoxyacetic acid
IUPAC NAME: 2-[4-(iodomethyl)phenoxy]-2-methoxyacetic acid
SYSTEMATIC NAME: 2-[4-(iodanylmethyl)phenoxy]-2-methoxy-ethanoic acid
MOLECULAR FORMULA: C10H11IO4
MOLECULAR WEIGHT: 322.09641
SMILES: COC(C(=O)O)OC1=CC=C(C=C1)CI
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Product OPENEYE NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]propanoate bromide
CAS Name: 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]propanoic acid ethyl ester bromide
IUPAC NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]propanoate bromide
SYSTEMATIC NAME: ethyl 2-[4-[(3-ethanoyl-2H-imidazol-1-yl)methyl]phenoxy]propanoate bromide
MOLECULAR FORMULA: C17H22BrN2O4-
MOLECULAR WEIGHT: 398.27158
SMILES: CCOC(=O)C(C)OC1=CC=C(C=C1)CN2CN(C=C2)C(=O)C.[Br-]
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Product OPENEYE NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]propanoate
CAS Name: 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]propanoic acid ethyl ester
IUPAC NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]propanoate
SYSTEMATIC NAME: ethyl 2-[4-[(3-ethanoyl-2H-imidazol-1-yl)methyl]phenoxy]propanoate
MOLECULAR FORMULA: C17H22N2O4
MOLECULAR WEIGHT: 318.36758
SMILES: CCOC(=O)C(C)OC1=CC=C(C=C1)CN2CN(C=C2)C(=O)C
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Product OPENEYE NAME: 3-[4-(2-iodoethoxy)phenyl]propanoic acid
CAS Name: 3-[4-(2-iodoethoxy)phenyl]propanoic acid
IUPAC NAME: 3-[4-(2-iodoethoxy)phenyl]propanoic acid
SYSTEMATIC NAME: 3-[4-(2-iodanylethoxy)phenyl]propanoic acid
MOLECULAR FORMULA: C11H13IO3
MOLECULAR WEIGHT: 320.12359
SMILES: C1=CC(=CC=C1CCC(=O)O)OCCI
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Product OPENEYE NAME: ethyl 4-[2-(3-acetyl-2H-imidazol-1-yl)ethoxy]benzoate iodide
CAS Name: 4-[2-(3-acetyl-2H-imidazol-1-yl)ethoxy]benzoic acid ethyl ester iodide
IUPAC NAME: ethyl 4-[2-(3-acetyl-2H-imidazol-1-yl)ethoxy]benzoate iodide
SYSTEMATIC NAME: ethyl 4-[2-(3-ethanoyl-2H-imidazol-1-yl)ethoxy]benzoate iodide
MOLECULAR FORMULA: C16H20IN2O4-
MOLECULAR WEIGHT: 431.24547
SMILES: CCOC(=O)C1=CC=C(C=C1)OCCN2CN(C=C2)C(=O)C.[I-]
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Product OPENEYE NAME: ethyl 4-[2-(3-acetyl-2H-imidazol-1-yl)ethoxy]benzoate
CAS Name: 4-[2-(3-acetyl-2H-imidazol-1-yl)ethoxy]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-[2-(3-acetyl-2H-imidazol-1-yl)ethoxy]benzoate
SYSTEMATIC NAME: ethyl 4-[2-(3-ethanoyl-2H-imidazol-1-yl)ethoxy]benzoate
MOLECULAR FORMULA: C16H20N2O4
MOLECULAR WEIGHT: 304.341
SMILES: CCOC(=O)C1=CC=C(C=C1)OCCN2CN(C=C2)C(=O)C
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Product OPENEYE NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetate bromide
CAS Name: 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetic acid ethyl ester bromide
IUPAC NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetate bromide
SYSTEMATIC NAME: ethyl 2-[4-[(3-ethanoyl-2H-imidazol-1-yl)methyl]phenoxy]ethanoate bromide
MOLECULAR FORMULA: C16H20BrN2O4-
MOLECULAR WEIGHT: 384.245
SMILES: CCOC(=O)COC1=CC=C(C=C1)CN2CN(C=C2)C(=O)C.[Br-]
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Product OPENEYE NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetate
CAS Name: 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetate
SYSTEMATIC NAME: ethyl 2-[4-[(3-ethanoyl-2H-imidazol-1-yl)methyl]phenoxy]ethanoate
MOLECULAR FORMULA: C16H20N2O4
MOLECULAR WEIGHT: 304.341
SMILES: CCOC(=O)COC1=CC=C(C=C1)CN2CN(C=C2)C(=O)C
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Product OPENEYE NAME: 2-[4-(bromomethyl)phenoxy]-2-methyl-propanoic acid
CAS Name: 2-[4-(bromomethyl)phenoxy]-2-methylpropanoic acid
IUPAC NAME: 2-[4-(bromomethyl)phenoxy]-2-methylpropanoic acid
SYSTEMATIC NAME: 2-[4-(bromomethyl)phenoxy]-2-methyl-propanoic acid
MOLECULAR FORMULA: C11H13BrO3
MOLECULAR WEIGHT: 273.12312
SMILES: CC(C)(C(=O)O)OC1=CC=C(C=C1)CBr
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Product OPENEYE NAME: 2-[4-(bromomethyl)phenoxy]propanoic acid
CAS Name: 2-[4-(bromomethyl)phenoxy]propanoic acid
IUPAC NAME: 2-[4-(bromomethyl)phenoxy]propanoic acid
SYSTEMATIC NAME: 2-[4-(bromomethyl)phenoxy]propanoic acid
MOLECULAR FORMULA: C10H11BrO3
MOLECULAR WEIGHT: 259.09654
SMILES: CC(C(=O)O)OC1=CC=C(C=C1)CBr
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Product OPENEYE NAME: (E)-3-[4-(2-iodoethoxy)phenyl]prop-2-enoic acid
CAS Name: (E)-3-[4-(2-iodoethoxy)phenyl]-2-propenoic acid
IUPAC NAME: (E)-3-[4-(2-iodoethoxy)phenyl]prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-[4-(2-iodanylethoxy)phenyl]prop-2-enoic acid
MOLECULAR FORMULA: C11H11IO3
MOLECULAR WEIGHT: 318.10771
SMILES: C1=CC(=CC=C1/C=C/C(=O)O)OCCI
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Product OPENEYE NAME: 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetonitrile iodide
CAS Name: 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetonitrile iodide
IUPAC NAME: 2-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenoxy]acetonitrile iodide
SYSTEMATIC NAME: 2-[4-[(3-ethanoyl-2H-imidazol-1-yl)methyl]phenoxy]ethanenitrile iodide
MOLECULAR FORMULA: C14H15IN3O2-
MOLECULAR WEIGHT: 384.19227
SMILES: CC(=O)N1CN(C=C1)CC2=CC=C(C=C2)OCC#N.[I-]
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