(4-ethanoylphenyl) 1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: (4-ethanoylphenyl) 1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: (4-acetylphenyl) 1-(benzenesulfonyl)piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-piperidinecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 1-(benzenesulfonyl)piperidine-4-carboxylate Traditional Name: 1-besylisonipecotic acid (4-acetylphenyl) ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO5S/c1-15(22)16-7-9-18(10-8-16)26-20(23)17-11-13-21(14-12-17)27(24,25)19-5-3-2-4-6-19/h2-10,17H,11-14H2,1H3