[1-oxidanylidene-1-(propylamino)propan-2-yl] 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 4-[methyl(p-tolylsulfonyl)amino]benzoate CAS Name: 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[methyl(tosyl)amino]benzoic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H26N2O5S/c1-5-14-22-20(24)16(3)28-21(25)17-8-10-18(11-9-17)23(4)29(26,27)19-12-6-15(2)7-13-19/h6-13,16H,5,14H2,1-4H3,(H,22,24)