N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-homopiperonyl-nipecotamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O5S/c24-21(22-11-10-16-8-9-19-20(13-16)28-15-27-19)17-5-4-12-23(14-17)29(25,26)18-6-2-1-3-7-18/h1-3,6-9,13,17H,4-5,10-12,14-15H2,(H,22,24)