[1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl] 2-ethylsulfonylbenzoate

Systemtic Name: [1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl] 2-ethylsulfonylbenzoate Openeye Name: [2-(4-acetamidophenyl)-1-methyl-2-oxo-ethyl] 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [1-(4-acetamidophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-acetamidophenyl)-1-oxopropan-2-yl] 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic 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:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OC(C)C(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OC(C)C(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C20H21NO6S/c1-4-28(25,26)18-8-6-5-7-17(18)20(24)27-13(2)19(23)15-9-11-16(12-10-15)21-14(3)22/h5-13H,4H2,1-3H3,(H,21,22)