[1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: [1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: [2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl] 3-[allyl-(4-chlorophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoic acid [1-(4-acetamidoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-acetamidoanilino)-1-oxopropan-2-yl] 3-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 3-[allyl-(4-chlorophenyl)sulfamoyl]benzoic acid [2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl] ester Formula: C27H26ClN3O6S MolecularWeight: 556.02984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N(CC=C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N(CC=C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C27H26ClN3O6S/c1-4-16-31(24-14-8-21(28)9-15-24)38(35,36)25-7-5-6-20(17-25)27(34)37-18(2)26(33)30-23-12-10-22(11-13-23)29-19(3)32/h4-15,17-18H,1,16H2,2-3H3,(H,29,32)(H,30,33)