[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] (2R)-1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] (2R)-1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: [2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl] (2R)-1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: (2R)-1-(benzenesulfonyl)-2-piperidinecarboxylic acid [2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] (2R)-1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: (2R)-1-besylpipecolinic acid [2-keto-2-[4-(2-pyridyl)piperazino]ethyl] ester Formula: C23H28N4O5S MolecularWeight: 472.55722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN([C@H](C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N4O5S/c28-22(26-16-14-25(15-17-26)21-11-4-6-12-24-21)18-32-23(29)20-10-5-7-13-27(20)33(30,31)19-8-2-1-3-9-19/h1-4,6,8-9,11-12,20H,5,7,10,13-18H2/t20-/m1/s1