ethyl 4-ethanoyl-1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-ethanoyl-1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: ethyl 4-acetyl-1-(benzenesulfonyl)piperidine-4-carboxylate CAS Name: 4-acetyl-1-(benzenesulfonyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-1-(benzenesulfonyl)piperidine-4-carboxylate Traditional Name: 4-acetyl-1-besyl-isonipecotic acid ethyl ester Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C(=O)C

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C16H21NO5S/c1-3-22-15(19)16(13(2)18)9-11-17(12-10-16)23(20,21)14-7-5-4-6-8-14/h4-8H,3,9-12H2,1-2H3