[1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonyl)propanoate

Systemtic Name: [1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonyl)propanoate Openeye Name: [2-(4-acetamidophenyl)-1-methyl-2-oxo-ethyl] 3-(benzenesulfonyl)propanoate CAS Name: 3-(benzenesulfonyl)propanoic acid [1-(4-acetamidophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-acetamidophenyl)-1-oxopropan-2-yl] 3-(benzenesulfonyl)propanoate Traditional Name: 3-besylpropionic acid [2-(4-acetamidophenyl)-2-keto-1-methyl-ethyl] ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)NC(=O)C)OC(=O)CCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)NC(=O)C)OC(=O)CCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21NO6S/c1-14(20(24)16-8-10-17(11-9-16)21-15(2)22)27-19(23)12-13-28(25,26)18-6-4-3-5-7-18/h3-11,14H,12-13H2,1-2H3,(H,21,22)