Wednesday, June 29, 2011

http://ChemLookup.com Compounds




CAS RN: 1131605-43-0
CAS Name: 2-amino-5-iodobenzoic acid phenyl ester
OPENEYE Name: phenyl 2-amino-5-iodo-benzoate
IUPAC Name: phenyl 2-amino-5-iodobenzoate
SYSTEMATIC NAME: phenyl 2-azanyl-5-iodanyl-benzoate
MOLECULAR FORMULA: C13H10INO2
MOLECULAR WEIGHT: 339.12847
SMILES: C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)I)N

CAS RN: 1131587-71-7
CAS Name: 2-amino-5-bromobenzoic acid phenyl ester
OPENEYE Name: phenyl 2-amino-5-bromo-benzoate
IUPAC Name: phenyl 2-amino-5-bromobenzoate
SYSTEMATIC NAME: phenyl 2-azanyl-5-bromanyl-benzoate
MOLECULAR FORMULA: C13H10BrNO2
MOLECULAR WEIGHT: 292.128
SMILES: C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)Br)N

CAS RN: 1131587-20-6
CAS Name: 2-amino-5-iodobenzoic acid (4-methylphenyl) ester
OPENEYE Name: p-tolyl 2-amino-5-iodo-benzoate
IUPAC Name: (4-methylphenyl) 2-amino-5-iodobenzoate
SYSTEMATIC NAME: (4-methylphenyl) 2-azanyl-5-iodanyl-benzoate
MOLECULAR FORMULA: C14H12INO2
MOLECULAR WEIGHT: 353.15505
SMILES: CC1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)I)N

CAS RN: 1131587-76-2
CAS Name: 2-amino-5-bromobenzoic acid (4-methylphenyl) ester
OPENEYE Name: p-tolyl 2-amino-5-bromo-benzoate
IUPAC Name: (4-methylphenyl) 2-amino-5-bromobenzoate
SYSTEMATIC NAME: (4-methylphenyl) 2-azanyl-5-bromanyl-benzoate
MOLECULAR FORMULA: C14H12BrNO2
MOLECULAR WEIGHT: 306.15458
SMILES: CC1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)Br)N

CAS RN: 1131622-72-4
CAS Name: 2-(3-butyl-1-piperazinyl)benzoic acid methyl ester
OPENEYE Name: methyl 2-(3-butylpiperazin-1-yl)benzoate
IUPAC Name: methyl 2-(3-butylpiperazin-1-yl)benzoate
SYSTEMATIC NAME: methyl 2-(3-butylpiperazin-1-yl)benzoate
MOLECULAR FORMULA: C16H24N2O2
MOLECULAR WEIGHT: 276.37396
SMILES: CCCCC1CN(CCN1)C2=CC=CC=C2C(=O)OC

CAS RN: 1131622-67-7
CAS Name: 2-(3-methyl-1-piperazinyl)benzoic acid methyl ester
OPENEYE Name: methyl 2-(3-methylpiperazin-1-yl)benzoate
IUPAC Name: methyl 2-(3-methylpiperazin-1-yl)benzoate
SYSTEMATIC NAME: methyl 2-(3-methylpiperazin-1-yl)benzoate
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: CC1CN(CCN1)C2=CC=CC=C2C(=O)OC

CAS RN: 1131622-61-1
CAS Name: 2-(2-methyl-1-piperazinyl)benzoic acid methyl ester
OPENEYE Name: methyl 2-(2-methylpiperazin-1-yl)benzoate
IUPAC Name: methyl 2-(2-methylpiperazin-1-yl)benzoate
SYSTEMATIC NAME: methyl 2-(2-methylpiperazin-1-yl)benzoate
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: CC1CNCCN1C2=CC=CC=C2C(=O)OC

CAS RN: 1131622-75-7
CAS Name: 2-[(3-butyl-1-piperazinyl)methyl]benzoic acid methyl ester
OPENEYE Name: methyl 2-[(3-butylpiperazin-1-yl)methyl]benzoate
IUPAC Name: methyl 2-[(3-butylpiperazin-1-yl)methyl]benzoate
SYSTEMATIC NAME: methyl 2-[(3-butylpiperazin-1-yl)methyl]benzoate
MOLECULAR FORMULA: C17H26N2O2
MOLECULAR WEIGHT: 290.40054
SMILES: CCCCC1CN(CCN1)CC2=CC=CC=C2C(=O)OC

CAS RN: 1131588-01-6
CAS Name: 2-[(3-ethyl-1-piperazinyl)methyl]benzoic acid methyl ester
OPENEYE Name: methyl 2-[(3-ethylpiperazin-1-yl)methyl]benzoate
IUPAC Name: methyl 2-[(3-ethylpiperazin-1-yl)methyl]benzoate
SYSTEMATIC NAME: methyl 2-[(3-ethylpiperazin-1-yl)methyl]benzoate
MOLECULAR FORMULA: C15H22N2O2
MOLECULAR WEIGHT: 262.34738
SMILES: CCC1CN(CCN1)CC2=CC=CC=C2C(=O)OC

CAS RN: 1131622-69-9
CAS Name: 2-[(3-methyl-1-piperazinyl)methyl]benzoic acid methyl ester
OPENEYE Name: methyl 2-[(3-methylpiperazin-1-yl)methyl]benzoate
IUPAC Name: methyl 2-[(3-methylpiperazin-1-yl)methyl]benzoate
SYSTEMATIC NAME: methyl 2-[(3-methylpiperazin-1-yl)methyl]benzoate
MOLECULAR FORMULA: C14H20N2O2
MOLECULAR WEIGHT: 248.3208
SMILES: CC1CN(CCN1)CC2=CC=CC=C2C(=O)OC

CAS RN: 1131622-64-4
CAS Name: 2-[(2-methyl-1-piperazinyl)methyl]benzoic acid methyl ester
OPENEYE Name: methyl 2-[(2-methylpiperazin-1-yl)methyl]benzoate
IUPAC Name: methyl 2-[(2-methylpiperazin-1-yl)methyl]benzoate
SYSTEMATIC NAME: methyl 2-[(2-methylpiperazin-1-yl)methyl]benzoate
MOLECULAR FORMULA: C14H20N2O2
MOLECULAR WEIGHT: 248.3208
SMILES: CC1CNCCN1CC2=CC=CC=C2C(=O)OC

CAS RN: 1131622-71-3
CAS Name: 3-(3-butyl-1-piperazinyl)benzoic acid methyl ester
OPENEYE Name: methyl 3-(3-butylpiperazin-1-yl)benzoate
IUPAC Name: methyl 3-(3-butylpiperazin-1-yl)benzoate
SYSTEMATIC NAME: methyl 3-(3-butylpiperazin-1-yl)benzoate
MOLECULAR FORMULA: C16H24N2O2
MOLECULAR WEIGHT: 276.37396
SMILES: CCCCC1CN(CCN1)C2=CC=CC(=C2)C(=O)OC

CAS RN: 1131622-66-6
CAS Name: 3-(3-methyl-1-piperazinyl)benzoic acid methyl ester
OPENEYE Name: methyl 3-(3-methylpiperazin-1-yl)benzoate
IUPAC Name: methyl 3-(3-methylpiperazin-1-yl)benzoate
SYSTEMATIC NAME: methyl 3-(3-methylpiperazin-1-yl)benzoate
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: CC1CN(CCN1)C2=CC=CC(=C2)C(=O)OC

CAS RN: 1131622-60-0
CAS Name: 3-(2-methyl-1-piperazinyl)benzoic acid methyl ester
OPENEYE Name: methyl 3-(2-methylpiperazin-1-yl)benzoate
IUPAC Name: methyl 3-(2-methylpiperazin-1-yl)benzoate
SYSTEMATIC NAME: methyl 3-(2-methylpiperazin-1-yl)benzoate
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: CC1CNCCN1C2=CC=CC(=C2)C(=O)OC

CAS RN: 1131622-74-6
CAS Name: 3-[(3-butyl-1-piperazinyl)methyl]benzoic acid methyl ester
OPENEYE Name: methyl 3-[(3-butylpiperazin-1-yl)methyl]benzoate
IUPAC Name: methyl 3-[(3-butylpiperazin-1-yl)methyl]benzoate
SYSTEMATIC NAME: methyl 3-[(3-butylpiperazin-1-yl)methyl]benzoate
MOLECULAR FORMULA: C17H26N2O2
MOLECULAR WEIGHT: 290.40054
SMILES: CCCCC1CN(CCN1)CC2=CC=CC(=C2)C(=O)OC

CAS RN: 1131622-68-8
CAS Name: 3-[(3-methyl-1-piperazinyl)methyl]benzoic acid methyl ester
OPENEYE Name: methyl 3-[(3-methylpiperazin-1-yl)methyl]benzoate
IUPAC Name: methyl 3-[(3-methylpiperazin-1-yl)methyl]benzoate
SYSTEMATIC NAME: methyl 3-[(3-methylpiperazin-1-yl)methyl]benzoate
MOLECULAR FORMULA: C14H20N2O2
MOLECULAR WEIGHT: 248.3208
SMILES: CC1CN(CCN1)CC2=CC=CC(=C2)C(=O)OC

CAS RN: 1131622-63-3
CAS Name: 3-[(2-methyl-1-piperazinyl)methyl]benzoic acid methyl ester
OPENEYE Name: methyl 3-[(2-methylpiperazin-1-yl)methyl]benzoate
IUPAC Name: methyl 3-[(2-methylpiperazin-1-yl)methyl]benzoate
SYSTEMATIC NAME: methyl 3-[(2-methylpiperazin-1-yl)methyl]benzoate
MOLECULAR FORMULA: C14H20N2O2
MOLECULAR WEIGHT: 248.3208
SMILES: CC1CNCCN1CC2=CC=CC(=C2)C(=O)OC

CAS RN: 1131614-90-8
CAS Name: 4-[3-(dimethylamino)propoxy]-3-iodobenzoic acid methyl ester
OPENEYE Name: methyl 4-[3-(dimethylamino)propoxy]-3-iodo-benzoate
IUPAC Name: methyl 4-[3-(dimethylamino)propoxy]-3-iodobenzoate
SYSTEMATIC NAME: methyl 4-[3-(dimethylamino)propoxy]-3-iodanyl-benzoate
MOLECULAR FORMULA: C13H18INO3
MOLECULAR WEIGHT: 363.19139
SMILES: CN(C)CCCOC1=C(C=C(C=C1)C(=O)OC)I

CAS RN: 1131614-42-0
CAS Name: 4-butoxy-3-iodobenzoic acid methyl ester
OPENEYE Name: methyl 4-butoxy-3-iodo-benzoate
IUPAC Name: methyl 4-butoxy-3-iodobenzoate
SYSTEMATIC NAME: methyl 4-butoxy-3-iodanyl-benzoate
MOLECULAR FORMULA: C12H15IO3
MOLECULAR WEIGHT: 334.15017
SMILES: CCCCOC1=C(C=C(C=C1)C(=O)OC)I

CAS RN: 1131614-13-5
CAS Name: 3-iodo-4-propoxybenzoic acid methyl ester
OPENEYE Name: methyl 3-iodo-4-propoxy-benzoate
IUPAC Name: methyl 3-iodo-4-propoxybenzoate
SYSTEMATIC NAME: methyl 3-iodanyl-4-propoxy-benzoate
MOLECULAR FORMULA: C11H13IO3
MOLECULAR WEIGHT: 320.12359
SMILES: CCCOC1=C(C=C(C=C1)C(=O)OC)I

CAS RN: 1131588-13-0
CAS Name: 4-ethoxy-3-iodobenzoic acid methyl ester
OPENEYE Name: methyl 4-ethoxy-3-iodo-benzoate
IUPAC Name: methyl 4-ethoxy-3-iodobenzoate
SYSTEMATIC NAME: methyl 4-ethoxy-3-iodanyl-benzoate
MOLECULAR FORMULA: C10H11IO3
MOLECULAR WEIGHT: 306.09701
SMILES: CCOC1=C(C=C(C=C1)C(=O)OC)I

CAS RN: 24507-28-6
CAS Name: 3-bromo-4-ethoxybenzoic acid methyl ester
OPENEYE Name: methyl 3-bromo-4-ethoxy-benzoate
IUPAC Name: methyl 3-bromo-4-ethoxybenzoate
SYSTEMATIC NAME: methyl 3-bromanyl-4-ethoxy-benzoate
MOLECULAR FORMULA: C10H11BrO3
MOLECULAR WEIGHT: 259.09654
SMILES: CCOC1=C(C=C(C=C1)C(=O)OC)Br

CAS RN: 1131614-23-7
CAS Name: 4-(difluoromethoxy)-3-iodobenzoic acid methyl ester
OPENEYE Name: methyl 4-(difluoromethoxy)-3-iodo-benzoate
IUPAC Name: methyl 4-(difluoromethoxy)-3-iodobenzoate
SYSTEMATIC NAME: methyl 4-[bis(fluoranyl)methoxy]-3-iodanyl-benzoate
MOLECULAR FORMULA: C9H7F2IO3
MOLECULAR WEIGHT: 328.051356
SMILES: COC(=O)C1=CC(=C(C=C1)OC(F)F)I

CAS RN: 1131614-65-7
CAS Name: 3-iodo-4-(trifluoromethoxy)benzoic acid methyl ester
OPENEYE Name: methyl 3-iodo-4-(trifluoromethoxy)benzoate
IUPAC Name: methyl 3-iodo-4-(trifluoromethoxy)benzoate
SYSTEMATIC NAME: methyl 3-iodanyl-4-(trifluoromethyloxy)benzoate
MOLECULAR FORMULA: C9H6F3IO3
MOLECULAR WEIGHT: 346.04182
SMILES: COC(=O)C1=CC(=C(C=C1)OC(F)(F)F)I

CAS RN: 1131614-15-7
CAS Name: 3-iodo-4-propan-2-yloxybenzoic acid methyl ester
OPENEYE Name: methyl 3-iodo-4-isopropoxy-benzoate
IUPAC Name: methyl 3-iodo-4-propan-2-yloxybenzoate
SYSTEMATIC NAME: methyl 3-iodanyl-4-propan-2-yloxy-benzoate
MOLECULAR FORMULA: C11H13IO3
MOLECULAR WEIGHT: 320.12359
SMILES: CC(C)OC1=C(C=C(C=C1)C(=O)OC)I

CAS RN: 1131614-03-3
CAS Name: 4-acetyloxy-3-iodobenzoic acid methyl ester
OPENEYE Name: methyl 4-acetoxy-3-iodo-benzoate
IUPAC Name: methyl 4-acetyloxy-3-iodobenzoate
SYSTEMATIC NAME: methyl 4-acetyloxy-3-iodanyl-benzoate
MOLECULAR FORMULA: C10H9IO4
MOLECULAR WEIGHT: 320.08053
SMILES: CC(=O)OC1=C(C=C(C=C1)C(=O)OC)I

CAS RN: 1131614-45-3
CAS Name: 3-iodo-4-[(2-methylpropan-2-yl)oxy]benzoic acid methyl ester
OPENEYE Name: methyl 4-tert-butoxy-3-iodo-benzoate
IUPAC Name: methyl 3-iodo-4-[(2-methylpropan-2-yl)oxy]benzoate
SYSTEMATIC NAME: methyl 3-iodanyl-4-[(2-methylpropan-2-yl)oxy]benzoate
MOLECULAR FORMULA: C12H15IO3
MOLECULAR WEIGHT: 334.15017
SMILES: CC(C)(C)OC1=C(C=C(C=C1)C(=O)OC)I

CAS RN: 868540-77-6
CAS Name: 3-iodo-4-(methylamino)benzoic acid methyl ester
OPENEYE Name: methyl 3-iodo-4-(methylamino)benzoate
IUPAC Name: methyl 3-iodo-4-(methylamino)benzoate
SYSTEMATIC NAME: methyl 3-iodanyl-4-(methylamino)benzoate
MOLECULAR FORMULA: C9H10INO2
MOLECULAR WEIGHT: 291.08567
SMILES: CNC1=C(C=C(C=C1)C(=O)OC)I

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