[2-(methylamino)-2-oxidanylidene-ethyl] 4-phenyl-1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: [2-(methylamino)-2-oxidanylidene-ethyl] 4-phenyl-1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: [2-(methylamino)-2-oxo-ethyl] 1-(benzenesulfonyl)-4-phenyl-piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-phenyl-4-piperidinecarboxylic acid [2-(methylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylamino)-2-oxoethyl] 1-(benzenesulfonyl)-4-phenylpiperidine-4-carboxylate Traditional Name: 1-besyl-4-phenyl-isonipecotic acid [2-keto-2-(methylamino)ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)COC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O5S/c1-22-19(24)16-28-20(25)21(17-8-4-2-5-9-17)12-14-23(15-13-21)29(26,27)18-10-6-3-7-11-18/h2-11H,12-16H2,1H3,(H,22,24)