[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate

Systemtic Name: [2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Openeye Name: [2-oxo-2-(p-tolylmethylamino)ethyl] 3-[allyl(phenyl)sulfamoyl]benzoate CAS Name: 3-[phenyl(prop-2-enyl)sulfamoyl]benzoic acid [2-[(4-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methylphenyl)methylamino]-2-oxoethyl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Traditional Name: 3-[allyl(phenyl)sulfamoyl]benzoic acid [2-keto-2-[(4-methylbenzyl)amino]ethyl] ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(CC=C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N(CC=C)C3=CC=CC=C3

InChI

InChI=1S/C26H26N2O5S/c1-3-16-28(23-9-5-4-6-10-23)34(31,32)24-11-7-8-22(17-24)26(30)33-19-25(29)27-18-21-14-12-20(2)13-15-21/h3-15,17H,1,16,18-19H2,2H3,(H,27,29)