Wednesday, June 29, 2011

http://ChemLookup.com Compounds




CAS RN: 1131587-97-7
CAS Name: 5-bromo-2-methoxy-4-(trifluoromethyl)benzoic acid methyl ester
OPENEYE Name: methyl 5-bromo-2-methoxy-4-(trifluoromethyl)benzoate
IUPAC Name: methyl 5-bromo-2-methoxy-4-(trifluoromethyl)benzoate
SYSTEMATIC NAME: methyl 5-bromanyl-2-methoxy-4-(trifluoromethyl)benzoate
MOLECULAR FORMULA: C10H8BrF3O3
MOLECULAR WEIGHT: 313.06793
SMILES: COC1=CC(=C(C=C1C(=O)OC)Br)C(F)(F)F

CAS RN: 1131587-92-2
CAS Name: 5-bromo-2-hydroxy-4-(trifluoromethyl)benzoic acid methyl ester
OPENEYE Name: methyl 5-bromo-2-hydroxy-4-(trifluoromethyl)benzoate
IUPAC Name: methyl 5-bromo-2-hydroxy-4-(trifluoromethyl)benzoate
SYSTEMATIC NAME: methyl 5-bromanyl-2-oxidanyl-4-(trifluoromethyl)benzoate
MOLECULAR FORMULA: C9H6BrF3O3
MOLECULAR WEIGHT: 299.04135
SMILES: COC(=O)C1=CC(=C(C=C1O)C(F)(F)F)Br

CAS RN: 1131605-44-1
CAS Name: 2-amino-5-iodobenzoic acid propan-2-yl ester
OPENEYE Name: isopropyl 2-amino-5-iodo-benzoate
IUPAC Name: propan-2-yl 2-amino-5-iodobenzoate
SYSTEMATIC NAME: propan-2-yl 2-azanyl-5-iodanyl-benzoate
MOLECULAR FORMULA: C10H12INO2
MOLECULAR WEIGHT: 305.11225
SMILES: CC(C)OC(=O)C1=C(C=CC(=C1)I)N

CAS RN: 934110-16-4
CAS Name: 2-amino-5-bromobenzoic acid propan-2-yl ester
OPENEYE Name: isopropyl 2-amino-5-bromo-benzoate
IUPAC Name: propan-2-yl 2-amino-5-bromobenzoate
SYSTEMATIC NAME: propan-2-yl 2-azanyl-5-bromanyl-benzoate
MOLECULAR FORMULA: C10H12BrNO2
MOLECULAR WEIGHT: 258.11178
SMILES: CC(C)OC(=O)C1=C(C=CC(=C1)Br)N

CAS RN: 889675-08-5
CAS Name: 2-[[2-ethyl-3-oxamoyl-1-(phenylmethyl)-4-indolyl]oxy]acetic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-(1-benzyl-2-ethyl-3-oxamoyl-indol-4-yl)oxyacetate
IUPAC Name: tert-butyl 2-(1-benzyl-2-ethyl-3-oxamoylindol-4-yl)oxyacetate
SYSTEMATIC NAME: tert-butyl 2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]oxyethanoate
MOLECULAR FORMULA: C25H28N2O5
MOLECULAR WEIGHT: 436.50022
SMILES: CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)OC(C)(C)C)C(=O)C(=O)N

CAS RN: 668261-27-6
CAS Name: 2-amino-5-iodobenzoic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-5-iodo-benzoate
IUPAC Name: tert-butyl 2-amino-5-iodobenzoate
SYSTEMATIC NAME: tert-butyl 2-azanyl-5-iodanyl-benzoate
MOLECULAR FORMULA: C11H14INO2
MOLECULAR WEIGHT: 319.13883
SMILES: CC(C)(C)OC(=O)C1=C(C=CC(=C1)I)N

CAS RN: 1131587-56-8
CAS Name: 2-amino-5-iodo-4-(trifluoromethyl)benzoic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate
IUPAC Name: tert-butyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate
SYSTEMATIC NAME: tert-butyl 2-azanyl-5-iodanyl-4-(trifluoromethyl)benzoate
MOLECULAR FORMULA: C12H13F3INO2
MOLECULAR WEIGHT: 387.1368
SMILES: CC(C)(C)OC(=O)C1=CC(=C(C=C1N)C(F)(F)F)I

CAS RN: 668969-63-9
CAS Name: 2-amino-5-bromobenzoic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-5-bromo-benzoate
IUPAC Name: tert-butyl 2-amino-5-bromobenzoate
SYSTEMATIC NAME: tert-butyl 2-azanyl-5-bromanyl-benzoate
MOLECULAR FORMULA: C11H14BrNO2
MOLECULAR WEIGHT: 272.13836
SMILES: CC(C)(C)OC(=O)C1=C(C=CC(=C1)Br)N

CAS RN: 1131587-98-8
CAS Name: 2-amino-5-bromo-4-(trifluoromethyl)benzoic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-5-bromo-4-(trifluoromethyl)benzoate
IUPAC Name: tert-butyl 2-amino-5-bromo-4-(trifluoromethyl)benzoate
SYSTEMATIC NAME: tert-butyl 2-azanyl-5-bromanyl-4-(trifluoromethyl)benzoate
MOLECULAR FORMULA: C12H13BrF3NO2
MOLECULAR WEIGHT: 340.13633
SMILES: CC(C)(C)OC(=O)C1=CC(=C(C=C1N)C(F)(F)F)Br

CAS RN: 87087-28-3
CAS Name: 3-(5-isoquinolinyl)propanoic acid
OPENEYE Name: 3-(5-isoquinolyl)propanoic acid
IUPAC Name: 3-isoquinolin-5-ylpropanoic acid
SYSTEMATIC NAME: 3-isoquinolin-5-ylpropanoic acid
MOLECULAR FORMULA: C12H11NO2
MOLECULAR WEIGHT: 201.22124
SMILES: C1=CC2=C(C=CN=C2)C(=C1)CCC(=O)O

CAS RN: 539814-13-6
CAS Name: 3-(4-methylsulfonyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-trien-5-yl)propanoic acid
OPENEYE Name: 3-(4-methylsulfonyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-trien-5-yl)propanoic acid
IUPAC Name: 3-(4-methylsulfonyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-trien-5-yl)propanoic acid
SYSTEMATIC NAME: 3-(4-methylsulfonyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-trien-5-yl)propanoic acid
MOLECULAR FORMULA: C10H10O5S
MOLECULAR WEIGHT: 242.2484
SMILES: CS(=O)(=O)C1=C(C2=C(O2)C=C1)CCC(=O)O

CAS RN: 1131614-52-2
CAS Name: 4-(2-ethoxyethoxy)-3-iodobenzoic acid
OPENEYE Name: 4-(2-ethoxyethoxy)-3-iodo-benzoic acid
IUPAC Name: 4-(2-ethoxyethoxy)-3-iodobenzoic acid
SYSTEMATIC NAME: 4-(2-ethoxyethoxy)-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C11H13IO4
MOLECULAR WEIGHT: 336.12299
SMILES: CCOCCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-51-1
CAS Name: 4-[2-(dimethylamino)ethoxy]-3-iodobenzoic acid
OPENEYE Name: 4-[2-(dimethylamino)ethoxy]-3-iodo-benzoic acid
IUPAC Name: 4-[2-(dimethylamino)ethoxy]-3-iodobenzoic acid
SYSTEMATIC NAME: 4-[2-(dimethylamino)ethoxy]-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C11H14INO3
MOLECULAR WEIGHT: 335.13823
SMILES: CN(C)CCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-78-2
CAS Name: 4-hexoxy-3-iodobenzoic acid
OPENEYE Name: 4-hexoxy-3-iodo-benzoic acid
IUPAC Name: 4-hexoxy-3-iodobenzoic acid
SYSTEMATIC NAME: 4-hexoxy-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C13H17IO3
MOLECULAR WEIGHT: 348.17675
SMILES: CCCCCCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-41-9
CAS Name: 3-iodo-4-pentoxybenzoic acid
OPENEYE Name: 3-iodo-4-pentoxy-benzoic acid
IUPAC Name: 3-iodo-4-pentoxybenzoic acid
SYSTEMATIC NAME: 3-iodanyl-4-pentoxy-benzoic acid
MOLECULAR FORMULA: C12H15IO3
MOLECULAR WEIGHT: 334.15017
SMILES: CCCCCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-07-7
CAS Name: 4-butoxy-3-iodobenzoic acid
OPENEYE Name: 4-butoxy-3-iodo-benzoic acid
IUPAC Name: 4-butoxy-3-iodobenzoic acid
SYSTEMATIC NAME: 4-butoxy-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C11H13IO3
MOLECULAR WEIGHT: 320.12359
SMILES: CCCCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131588-12-9
CAS Name: 3-iodo-4-propoxybenzoic acid
OPENEYE Name: 3-iodo-4-propoxy-benzoic acid
IUPAC Name: 3-iodo-4-propoxybenzoic acid
SYSTEMATIC NAME: 3-iodanyl-4-propoxy-benzoic acid
MOLECULAR FORMULA: C10H11IO3
MOLECULAR WEIGHT: 306.09701
SMILES: CCCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-43-1
CAS Name: 3-iodo-4-(3-methylbutoxy)benzoic acid
OPENEYE Name: 3-iodo-4-isopentyloxy-benzoic acid
IUPAC Name: 3-iodo-4-(3-methylbutoxy)benzoic acid
SYSTEMATIC NAME: 3-iodanyl-4-(3-methylbutoxy)benzoic acid
MOLECULAR FORMULA: C12H15IO3
MOLECULAR WEIGHT: 334.15017
SMILES: CC(C)CCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-89-5
CAS Name: 3-iodo-4-(4-oxanylmethoxy)benzoic acid
OPENEYE Name: 3-iodo-4-(tetrahydropyran-4-ylmethoxy)benzoic acid
IUPAC Name: 3-iodo-4-(oxan-4-ylmethoxy)benzoic acid
SYSTEMATIC NAME: 3-iodanyl-4-(oxan-4-ylmethoxy)benzoic acid
MOLECULAR FORMULA: C13H15IO4
MOLECULAR WEIGHT: 362.16027
SMILES: C1COCCC1COC2=C(C=C(C=C2)C(=O)O)I

CAS RN: 1131614-94-2
CAS Name: 4-[(2-fluorophenyl)methoxy]-3-iodobenzoic acid
OPENEYE Name: 4-[(2-fluorophenyl)methoxy]-3-iodo-benzoic acid
IUPAC Name: 4-[(2-fluorophenyl)methoxy]-3-iodobenzoic acid
SYSTEMATIC NAME: 4-[(2-fluorophenyl)methoxy]-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C14H10FIO3
MOLECULAR WEIGHT: 372.130273
SMILES: C1=CC=C(C(=C1)COC2=C(C=C(C=C2)C(=O)O)I)F

CAS RN: 82998-76-3
CAS Name: 4-ethoxy-3-iodobenzoic acid
OPENEYE Name: 4-ethoxy-3-iodo-benzoic acid
IUPAC Name: 4-ethoxy-3-iodobenzoic acid
SYSTEMATIC NAME: 4-ethoxy-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C9H9IO3
MOLECULAR WEIGHT: 292.07043
SMILES: CCOC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-66-8
CAS Name: 3-iodo-4-(2,2,2-trifluoroethoxy)benzoic acid
OPENEYE Name: 3-iodo-4-(2,2,2-trifluoroethoxy)benzoic acid
IUPAC Name: 3-iodo-4-(2,2,2-trifluoroethoxy)benzoic acid
SYSTEMATIC NAME: 3-iodanyl-4-[2,2,2-tris(fluoranyl)ethoxy]benzoic acid
MOLECULAR FORMULA: C9H6F3IO3
MOLECULAR WEIGHT: 346.04182
SMILES: C1=CC(=C(C=C1C(=O)O)I)OCC(F)(F)F

CAS RN: 1131614-19-1
CAS Name: 3-iodo-4-(2-methylpropoxy)benzoic acid
OPENEYE Name: 3-iodo-4-isobutoxy-benzoic acid
IUPAC Name: 3-iodo-4-(2-methylpropoxy)benzoic acid
SYSTEMATIC NAME: 3-iodanyl-4-(2-methylpropoxy)benzoic acid
MOLECULAR FORMULA: C11H13IO3
MOLECULAR WEIGHT: 320.12359
SMILES: CC(C)COC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131614-48-6
CAS Name: 4-(2,2-dimethylpropoxy)-3-iodobenzoic acid
OPENEYE Name: 4-(2,2-dimethylpropoxy)-3-iodo-benzoic acid
IUPAC Name: 4-(2,2-dimethylpropoxy)-3-iodobenzoic acid
SYSTEMATIC NAME: 4-(2,2-dimethylpropoxy)-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C12H15IO3
MOLECULAR WEIGHT: 334.15017
SMILES: CC(C)(C)COC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131622-52-0
CAS Name: 3-bromo-4-(2,2-dimethylpropoxy)benzoic acid
OPENEYE Name: 3-bromo-4-(2,2-dimethylpropoxy)benzoic acid
IUPAC Name: 3-bromo-4-(2,2-dimethylpropoxy)benzoic acid
SYSTEMATIC NAME: 3-bromanyl-4-(2,2-dimethylpropoxy)benzoic acid
MOLECULAR FORMULA: C12H15BrO3
MOLECULAR WEIGHT: 287.1497
SMILES: CC(C)(C)COC1=C(C=C(C=C1)C(=O)O)Br

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