1-(2-chlorophenyl)ethyl 1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: 1-(2-chlorophenyl)ethyl 1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: 1-(2-chlorophenyl)ethyl 1-(benzenesulfonyl)piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-piperidinecarboxylic acid 1-(2-chlorophenyl)ethyl ester IUPAC Name: 1-(2-chlorophenyl)ethyl 1-(benzenesulfonyl)piperidine-4-carboxylate Traditional Name: 1-besylisonipecotic acid 1-(2-chlorophenyl)ethyl ester Formula: C20H22ClNO4S MolecularWeight: 407.91098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1Cl)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClNO4S/c1-15(18-9-5-6-10-19(18)21)26-20(23)16-11-13-22(14-12-16)27(24,25)17-7-3-2-4-8-17/h2-10,15-16H,11-14H2,1H3