N-[(2-ethoxypyridin-3-yl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(2-ethoxypyridin-3-yl)methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(2-ethoxy-3-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(2-ethoxy-3-pyridinyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(2-ethoxypyridin-3-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(2-ethoxy-3-pyridyl)methyl]isonipecotamide Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC=N1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O4S/c1-2-27-20-17(7-6-12-21-20)15-22-19(24)16-10-13-23(14-11-16)28(25,26)18-8-4-3-5-9-18/h3-9,12,16H,2,10-11,13-15H2,1H3,(H,22,24)