Monday, October 31, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 3-(2-hydroxyphenoxy)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-hydroxyphenoxy)propyl ester
IUPAC NAME: 3-(2-hydroxyphenoxy)propyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: 3-(2-oxidanylphenoxy)propyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C17H14O6
MOLECULAR WEIGHT: 314.28946
SMILES: C1=CC=C(C(=C1)O)OCCCOC(=O)C(=O)C2=C3C(=CC=C2)O3
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Product OPENEYE NAME: [6-(ethoxysulfonylmethoxy)-2-naphthyl] acetate
CAS Name: acetic acid [6-(ethoxysulfonylmethoxy)-2-naphthalenyl] ester
IUPAC NAME: [6-(ethoxysulfonylmethoxy)naphthalen-2-yl] acetate
SYSTEMATIC NAME: [6-(ethoxysulfonylmethoxy)naphthalen-2-yl] ethanoate
MOLECULAR FORMULA: C15H16O6S
MOLECULAR WEIGHT: 324.34894
SMILES: CCOS(=O)(=O)COC1=CC2=C(C=C1)C=C(C=C2)OC(=O)C
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Product OPENEYE NAME: benzyl 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid (phenylmethyl) ester
IUPAC NAME: benzyl 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: (phenylmethyl) 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C15H12O4
MOLECULAR WEIGHT: 256.25338
SMILES: C1=CC=C(C=C1)COOC(=O)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[2-(2,3,5,6-tetrafluorocyclohexa-1,5-dien-1-yl)oxyethoxy]naphthalene
CAS Name: 2-[2-[(2,3,5,6-tetrafluoro-1-cyclohexa-1,5-dienyl)oxy]ethoxy]naphthalene
IUPAC NAME: 2-[2-(2,3,5,6-tetrafluorocyclohexa-1,5-dien-1-yl)oxyethoxy]naphthalene
SYSTEMATIC NAME: 2-[2-[2,3,5,6-tetrakis(fluoranyl)cyclohexa-1,5-dien-1-yl]oxyethoxy]naphthalene
MOLECULAR FORMULA: C18H14F4O2
MOLECULAR WEIGHT: 338.296173
SMILES: C1C(C(=C(C(=C1F)F)OCCOC2=CC3=CC=CC=C3C=C2)F)F
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Product OPENEYE NAME: 2-[(8-hydroxy-2-naphthyl)oxy]ethyl 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid 2-[(8-hydroxy-2-naphthalenyl)oxy]ethyl ester
IUPAC NAME: 2-(8-hydroxynaphthalen-2-yl)oxyethyl 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: 2-(8-oxidanylnaphthalen-2-yl)oxyethyl 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C20H16O6
MOLECULAR WEIGHT: 352.33744
SMILES: C1=CC=C(C=C1)C(=O)C(=O)OOCCOC2=CC3=C(C=CC=C3O)C=C2
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Product OPENEYE NAME: 3-(2-naphthylsulfanyl)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-naphthalenylthio)propyl ester
IUPAC NAME: 3-naphthalen-2-ylsulfanylpropyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: 3-naphthalen-2-ylsulfanylpropyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C21H16O4S
MOLECULAR WEIGHT: 364.41434
SMILES: C1=CC=C2C=C(C=CC2=C1)SCCCOC(=O)C(=O)C3=C4C(=CC=C3)O4
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Product OPENEYE NAME: N-ethoxy-2-oxo-2-(2-thienyl)acetamide
CAS Name: N-ethoxy-2-oxo-2-thiophen-2-ylacetamide
IUPAC NAME: N-ethoxy-2-oxo-2-thiophen-2-ylacetamide
SYSTEMATIC NAME: N-ethoxy-2-oxidanylidene-2-thiophen-2-yl-ethanamide
MOLECULAR FORMULA: C8H9NO3S
MOLECULAR WEIGHT: 199.22696
SMILES: CCONC(=O)C(=O)C1=CC=CS1
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Product OPENEYE NAME: [4-hydroxy-4-(2-naphthyl)butyl] 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid [4-hydroxy-4-(2-naphthalenyl)butyl] ester
IUPAC NAME: (4-hydroxy-4-naphthalen-2-ylbutyl) 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: (4-naphthalen-2-yl-4-oxidanyl-butyl) 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C22H20O5
MOLECULAR WEIGHT: 364.3912
SMILES: C1=CC=C(C=C1)C(=O)C(=O)OOCCCC(C2=CC3=CC=CC=C3C=C2)O
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Product OPENEYE NAME: tert-butoxycarbonyl 2-[4-[2-(cyclooctoxy)ethyl]phenyl]-2-oxo-acetate
CAS Name: 2-[4-(2-cyclooctyloxyethyl)phenyl]-2-oxoacetic acid [(2-methylpropan-2-yl)oxy-oxomethyl] ester
IUPAC NAME: (2-methylpropan-2-yl)oxycarbonyl 2-[4-(2-cyclooctyloxyethyl)phenyl]-2-oxoacetate
SYSTEMATIC NAME: (2-methylpropan-2-yl)oxycarbonyl 2-[4-(2-cyclooctyloxyethyl)phenyl]-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C23H32O6
MOLECULAR WEIGHT: 404.49658
SMILES: CC(C)(C)OC(=O)OC(=O)C(=O)C1=CC=C(C=C1)CCOC2CCCCCCC2
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Product OPENEYE NAME: (4-hydroxy-5-oxo-5-phenyl-pentyl) 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid (4-hydroxy-5-oxo-5-phenylpentyl) ester
IUPAC NAME: (4-hydroxy-5-oxo-5-phenylpentyl) 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: (4-oxidanyl-5-oxidanylidene-5-phenyl-pentyl) 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C19H18O6
MOLECULAR WEIGHT: 342.34262
SMILES: C1=CC=C(C=C1)C(=O)C(CCCOOC(=O)C(=O)C2=CC=CC=C2)O
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Product OPENEYE NAME: 2-[2-(5-fluorocyclohexa-1,5-dien-1-yl)oxyethoxy]naphthalene
CAS Name: 2-[2-[(5-fluoro-1-cyclohexa-1,5-dienyl)oxy]ethoxy]naphthalene
IUPAC NAME: 2-[2-(5-fluorocyclohexa-1,5-dien-1-yl)oxyethoxy]naphthalene
SYSTEMATIC NAME: 2-[2-(5-fluoranylcyclohexa-1,5-dien-1-yl)oxyethoxy]naphthalene
MOLECULAR FORMULA: C18H17FO2
MOLECULAR WEIGHT: 284.324783
SMILES: C1CC(=CC(=C1)OCCOC2=CC3=CC=CC=C3C=C2)F
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Product OPENEYE NAME: 2-[3-methyl-2-[3-(o-tolyl)prop-2-ynoxy]phenyl]-2-oxo-acetic acid
CAS Name: 2-[3-methyl-2-[3-(2-methylphenyl)prop-2-ynoxy]phenyl]-2-oxoacetic acid
IUPAC NAME: 2-[3-methyl-2-[3-(2-methylphenyl)prop-2-ynoxy]phenyl]-2-oxoacetic acid
SYSTEMATIC NAME: 2-[3-methyl-2-[3-(2-methylphenyl)prop-2-ynoxy]phenyl]-2-oxidanylidene-ethanoic acid
MOLECULAR FORMULA: C19H16O4
MOLECULAR WEIGHT: 308.32794
SMILES: CC1=CC=CC=C1C#CCOC2=C(C=CC=C2C)C(=O)C(=O)O
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Product OPENEYE NAME: amino 2-[2-[2-(2-naphthyloxy)acetyl]phenyl]-2-oxo-acetate
CAS Name: 2-[2-[2-(2-naphthalenyloxy)-1-oxoethyl]phenyl]-2-oxoacetic acid amino ester
IUPAC NAME: amino 2-[2-(2-naphthalen-2-yloxyacetyl)phenyl]-2-oxoacetate
SYSTEMATIC NAME: azanyl 2-[2-(2-naphthalen-2-yloxyethanoyl)phenyl]-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C20H15NO5
MOLECULAR WEIGHT: 349.3368
SMILES: C1=CC=C2C=C(C=CC2=C1)OCC(=O)C3=CC=CC=C3C(=O)C(=O)ON
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Product OPENEYE NAME: 2-(1-naphthyloxy)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-(1-naphthalenyloxy)ethyl ester
IUPAC NAME: 2-naphthalen-1-yloxyethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxoacetate
SYSTEMATIC NAME: 2-naphthalen-1-yloxyethyl 2-(7-oxabicyclo[4.1.0]hepta-1,3,5-trien-5-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C20H14O5
MOLECULAR WEIGHT: 334.32216
SMILES: C1=CC=C2C(=C1)C=CC=C2OCCOC(=O)C(=O)C3=C4C(=CC=C3)O4
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Product OPENEYE NAME: 3-(2-oxo-1-quinolyl)propyl 2-oxo-2-phenyl-peroxyacetate
CAS Name: 2-oxo-2-phenylethaneperoxoic acid 3-(2-oxo-1-quinolinyl)propyl ester
IUPAC NAME: 3-(2-oxoquinolin-1-yl)propyl 2-oxo-2-phenylethaneperoxoate
SYSTEMATIC NAME: 3-(2-oxidanylidenequinolin-1-yl)propyl 2-oxidanylidene-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C20H17NO5
MOLECULAR WEIGHT: 351.35268
SMILES: C1=CC=C(C=C1)C(=O)C(=O)OOCCCN2C(=O)C=CC3=CC=CC=C32
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