N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-phenyl-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-phenylpiperidine-4-carboxamide Traditional Name: 1-besyl-4-phenyl-N-piperonyl-isonipecotamide Formula: C26H26N2O5S MolecularWeight: 478.56004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H26N2O5S/c29-25(27-18-20-11-12-23-24(17-20)33-19-32-23)26(21-7-3-1-4-8-21)13-15-28(16-14-26)34(30,31)22-9-5-2-6-10-22/h1-12,17H,13-16,18-19H2,(H,27,29)