Monday, October 31, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 1-[(3-benzyloxy-2-naphthyl)oxy]ethanol
CAS Name: 1-[(3-phenylmethoxy-2-naphthalenyl)oxy]ethanol
IUPAC NAME: 1-(3-phenylmethoxynaphthalen-2-yl)oxyethanol
SYSTEMATIC NAME: 1-(3-phenylmethoxynaphthalen-2-yl)oxyethanol
MOLECULAR FORMULA: C19H18O3
MOLECULAR WEIGHT: 294.34442
SMILES: CC(O)OC1=CC2=CC=CC=C2C=C1OCC3=CC=CC=C3
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Product OPENEYE NAME: [4-(2-naphthyl)-4-oxo-butyl] 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxo-acetate
CAS Name: 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetic acid [4-(2-naphthalenyl)-4-oxobutyl] ester
IUPAC NAME: (4-naphthalen-2-yl-4-oxobutyl) 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: (4-naphthalen-2-yl-4-oxidanylidene-butyl) 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C22H16O5
MOLECULAR WEIGHT: 360.35944
SMILES: C1=CC=C2C=C(C=CC2=C1)C(=O)CCCOC(=O)C(=O)C3=C4C(=CC=C3)O4
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Product OPENEYE NAME: [4-(2-naphthyl)-4-oxo-butyl] 2-[2-[tert-butyl(dimethyl)silyl]phenyl]-2-oxo-peroxyacetate
CAS Name: 2-[2-[tert-butyl(dimethyl)silyl]phenyl]-2-oxoethaneperoxoic acid [4-(2-naphthalenyl)-4-oxobutyl] ester
IUPAC NAME: (4-naphthalen-2-yl-4-oxobutyl) 2-[2-[tert-butyl(dimethyl)silyl]phenyl]-2-oxoethaneperoxoate
SYSTEMATIC NAME: (4-naphthalen-2-yl-4-oxidanylidene-butyl) 2-[2-[tert-butyl(dimethyl)silyl]phenyl]-2-oxidanylidene-ethaneperoxoate
MOLECULAR FORMULA: C28H32O5Si
MOLECULAR WEIGHT: 476.63618
SMILES: CC(C)(C)[Si](C)(C)C1=CC=CC=C1C(=O)C(=O)OOCCCC(=O)C2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: (2-morpholino-2-oxo-ethyl) 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid [2-(4-morpholinyl)-2-oxoethyl] ester
IUPAC NAME: (2-morpholin-4-yl-2-oxoethyl) 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C14H15NO6
MOLECULAR WEIGHT: 293.272
SMILES: C1COCCN1C(=O)COOC(=O)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[3-[2-(2-fluorophenoxy)ethoxy]-2-oxo-3-pyridyl]acetic acid
CAS Name: 2-[3-[2-(2-fluorophenoxy)ethoxy]-2-oxo-3-pyridinyl]acetic acid
IUPAC NAME: 2-[3-[2-(2-fluorophenoxy)ethoxy]-2-oxopyridin-3-yl]acetic acid
SYSTEMATIC NAME: 2-[3-[2-(2-fluoranylphenoxy)ethoxy]-2-oxidanylidene-pyridin-3-yl]ethanoic acid
MOLECULAR FORMULA: C15H14FNO5
MOLECULAR WEIGHT: 307.273763
SMILES: C1=CC=C(C(=C1)OCCOC2(C=CC=NC2=O)CC(=O)O)F
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Product OPENEYE NAME: 2-(3,4-dimethoxyphenoxy)ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxo-acetate
CAS Name: 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetic acid 2-(3,4-dimethoxyphenoxy)ethyl ester
IUPAC NAME: 2-(3,4-dimethoxyphenoxy)ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenoxy)ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C18H16O7
MOLECULAR WEIGHT: 344.31544
SMILES: COC1=C(C=C(C=C1)OCCOC(=O)C(=O)C2=C3C(=CC=C2)O3)OC
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Product OPENEYE NAME: 3-[2-(dimethylamino)phenyl]propyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxo-acetate
CAS Name: 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetic acid 3-[2-(dimethylamino)phenyl]propyl ester
IUPAC NAME: 3-[2-(dimethylamino)phenyl]propyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: 3-[2-(dimethylamino)phenyl]propyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C19H19NO4
MOLECULAR WEIGHT: 325.35846
SMILES: CN(C)C1=CC=CC=C1CCCOC(=O)C(=O)C2=C3C(=CC=C2)O3
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Product OPENEYE NAME: 2-[4-(methylsulfamoyl)phenoxy]ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxo-acetate
CAS Name: 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetic acid 2-[4-(methylsulfamoyl)phenoxy]ethyl ester
IUPAC NAME: 2-[4-(methylsulfamoyl)phenoxy]ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: 2-[4-(methylsulfamoyl)phenoxy]ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C17H15NO7S
MOLECULAR WEIGHT: 377.3685
SMILES: CNS(=O)(=O)C1=CC=C(C=C1)OCCOC(=O)C(=O)C2=C3C(=CC=C2)O3
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Product OPENEYE NAME: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl] 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C19H17NO5
MOLECULAR WEIGHT: 339.34198
SMILES: C1CN(CC2=CC=CC=C21)C(=O)COOC(=O)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (2-ethylpiperazin-1-yl) 2-[2-ethoxy-3-[2-(trifluoromethyl)phenyl]phenyl]acetate
CAS Name: 2-[2-ethoxy-3-[2-(trifluoromethyl)phenyl]phenyl]acetic acid (2-ethyl-1-piperazinyl) ester
IUPAC NAME: (2-ethylpiperazin-1-yl) 2-[2-ethoxy-3-[2-(trifluoromethyl)phenyl]phenyl]acetate
SYSTEMATIC NAME: (2-ethylpiperazin-1-yl) 2-[2-ethoxy-3-[2-(trifluoromethyl)phenyl]phenyl]ethanoate
MOLECULAR FORMULA: C23H27F3N2O3
MOLECULAR WEIGHT: 436.46729
SMILES: CCC1CNCCN1OC(=O)CC2=CC=CC(=C2OCC)C3=CC=CC=C3C(F)(F)F
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Product OPENEYE NAME: 2-(2-fluorophenoxy)ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxo-acetate
CAS Name: 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetic acid 2-(2-fluorophenoxy)ethyl ester
IUPAC NAME: 2-(2-fluorophenoxy)ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: 2-(2-fluoranylphenoxy)ethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C16H11FO5
MOLECULAR WEIGHT: 302.253943
SMILES: C1=CC=C(C(=C1)OCCOC(=O)C(=O)C2=C3C(=CC=C2)O3)F
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Product OPENEYE NAME: [2-oxo-2-(4-phenyl-1-piperidyl)ethyl] 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid [2-oxo-2-(4-phenyl-1-piperidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(4-phenylpiperidin-1-yl)ethyl] 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylpiperidin-1-yl)ethyl] 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C21H21NO5
MOLECULAR WEIGHT: 367.39514
SMILES: C1CN(CCC1C2=CC=CC=C2)C(=O)COOC(=O)C(=O)C3=CC=CC=C3
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