[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-[(4-bromophenyl)sulfonylamino]benzoate

Systemtic Name: [2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-[(4-bromophenyl)sulfonylamino]benzoate Openeye Name: [2-(3-methoxyanilino)-2-oxo-1-phenyl-ethyl] 2-[(4-bromophenyl)sulfonylamino]benzoate CAS Name: 2-[(4-bromophenyl)sulfonylamino]benzoic acid [2-(3-methoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3-methoxyanilino)-2-oxo-1-phenylethyl] 2-[(4-bromophenyl)sulfonylamino]benzoate Traditional Name: 2-(brosylamino)benzoic acid [2-keto-2-(m-anisidino)-1-phenyl-ethyl] ester Formula: C28H23BrN2O6S MolecularWeight: 595.46102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H23BrN2O6S/c1-36-22-11-7-10-21(18-22)30-27(32)26(19-8-3-2-4-9-19)37-28(33)24-12-5-6-13-25(24)31-38(34,35)23-16-14-20(29)15-17-23/h2-18,26,31H,1H3,(H,30,32)