[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonylamino]-3-oxidanyl-butanoate

Systemtic Name: [2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonylamino]-3-oxidanyl-butanoate Openeye Name: [2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxy-butanoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxybutanoic acid [2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl] 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxybutanoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxy-butyric acid [2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C21H25ClN2O6S MolecularWeight: 468.951

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)C(C(C)O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)C(C(C)O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C21H25ClN2O6S/c1-4-15-7-5-6-13(2)19(15)23-18(26)12-30-21(27)20(14(3)25)24-31(28,29)17-10-8-16(22)9-11-17/h5-11,14,20,24-25H,4,12H2,1-3H3,(H,23,26)