ethyl 1-(phenylsulfonyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(phenylsulfonyl)piperidine-3-carboxylate Openeye Name: ethyl 1-(benzenesulfonyl)piperidine-3-carboxylate CAS Name: 1-(benzenesulfonyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzenesulfonyl)piperidine-3-carboxylate Traditional Name: 1-besylnipecotic acid ethyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H19NO4S/c1-2-19-14(16)12-7-6-10-15(11-12)20(17,18)13-8-4-3-5-9-13/h3-5,8-9,12H,2,6-7,10-11H2,1H3