[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(phenylsulfonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-(phenylsulfonylamino)propanoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(benzenesulfonamido)propanoate CAS Name: 3-(benzenesulfonamido)propanoic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-(benzenesulfonamido)propanoate Traditional Name: 3-(benzenesulfonamido)propionic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)CCNS(=O)(=O)C2=CC=CC=C2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)CCNS(=O)(=O)C2=CC=CC=C2)C)C

InChI

InChI=1S/C20H23NO5S/c1-14-11-16(3)18(12-15(14)2)19(22)13-26-20(23)9-10-21-27(24,25)17-7-5-4-6-8-17/h4-8,11-12,21H,9-10,13H2,1-3H3