[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 1-ethylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 1-ethylsulfonylpiperidine-4-carboxylate Openeye Name: [2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl] 1-ethylsulfonylpiperidine-4-carboxylate CAS Name: 1-ethylsulfonyl-4-piperidinecarboxylic acid [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 1-ethylsulfonylpiperidine-4-carboxylate Traditional Name: 1-esylisonipecotic acid [2-[(2-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C17H23ClN2O5S MolecularWeight: 402.89292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)OCC(=O)NCC2=CC=CC=C2Cl

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)OCC(=O)NCC2=CC=CC=C2Cl

InChI

InChI=1S/C17H23ClN2O5S/c1-2-26(23,24)20-9-7-13(8-10-20)17(22)25-12-16(21)19-11-14-5-3-4-6-15(14)18/h3-6,13H,2,7-12H2,1H3,(H,19,21)