[1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonylamino)benzoate

Systemtic Name: [1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonylamino)benzoate Openeye Name: [2-(4-chloroanilino)-1-methyl-2-oxo-ethyl] 3-(benzenesulfonamido)benzoate CAS Name: 3-(benzenesulfonamido)benzoic acid [1-(4-chloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chloroanilino)-1-oxopropan-2-yl] 3-(benzenesulfonamido)benzoate Traditional Name: 3-(benzenesulfonamido)benzoic acid [2-(4-chloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H19ClN2O5S MolecularWeight: 458.91466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19ClN2O5S/c1-15(21(26)24-18-12-10-17(23)11-13-18)30-22(27)16-6-5-7-19(14-16)25-31(28,29)20-8-3-2-4-9-20/h2-15,25H,1H3,(H,24,26)