[2-acetamido-3-(4-methylsulfonylphenyl)-3-oxidanylidene-propyl] ethanoate

Systemtic Name: [2-acetamido-3-(4-methylsulfonylphenyl)-3-oxidanylidene-propyl] ethanoate Openeye Name: [2-acetamido-3-(4-methylsulfonylphenyl)-3-oxo-propyl] acetate CAS Name: acetic acid [2-acetamido-3-(4-methylsulfonylphenyl)-3-oxopropyl] ester IUPAC Name: [2-acetamido-3-(4-methylsulfonylphenyl)-3-oxopropyl] acetate Traditional Name: acetic acid [2-acetamido-3-keto-3-(4-mesylphenyl)propyl] ester Formula: C14H17NO6S MolecularWeight: 327.35288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(COC(=O)C)C(=O)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

CC(=O)NC(COC(=O)C)C(=O)C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C14H17NO6S/c1-9(16)15-13(8-21-10(2)17)14(18)11-4-6-12(7-5-11)22(3,19)20/h4-7,13H,8H2,1-3H3,(H,15,16)