[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClN2O5S/c1-3-15(4-2)22-19(24)13-28-20(25)17-7-5-6-8-18(17)23-29(26,27)16-11-9-14(21)10-12-16/h5-12,15,23H,3-4,13H2,1-2H3,(H,22,24)