N-[4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide

Systemtic Name: N-[4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide Openeye Name: N-[4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carbonyl]phenyl]methanesulfonamide CAS Name: N-[4-[[1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-piperidinyl]-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[4-(1-homopiperonylisonipecotoyl)phenyl]methanesulfonamide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N2O5S/c1-30(26,27)23-19-5-3-17(4-6-19)22(25)18-9-12-24(13-10-18)11-8-16-2-7-20-21(14-16)29-15-28-20/h2-7,14,18,23H,8-13,15H2,1H3