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

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O5S/c1-3-13(2)21-18(23)12-27-19(24)16-6-4-5-7-17(16)22-28(25,26)15-10-8-14(20)9-11-15/h4-11,13,22H,3,12H2,1-2H3,(H,21,23)