[1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Openeye Name: [1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-chlorophenyl)sulfonylamino]propanoic acid [1-(3-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-methylanilino)-1-oxopropan-2-yl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]propionic acid [2-keto-1-methyl-2-(m-toluidino)ethyl] ester Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H21ClN2O5S/c1-13-4-3-5-16(12-13)22-19(24)14(2)27-18(23)10-11-21-28(25,26)17-8-6-15(20)7-9-17/h3-9,12,14,21H,10-11H2,1-2H3,(H,22,24)