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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-besyl-N-piperonyl-nipecotamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O5S/c23-20(21-12-15-8-9-18-19(11-15)27-14-26-18)16-5-4-10-22(13-16)28(24,25)17-6-2-1-3-7-17/h1-3,6-9,11,16H,4-5,10,12-14H2,(H,21,23)