1-(1,3-benzodioxol-5-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-ylsulfonyl)-N-o-anisyl-nipecotamide Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O6S/c1-27-18-7-3-2-5-15(18)12-22-21(24)16-6-4-10-23(13-16)30(25,26)17-8-9-19-20(11-17)29-14-28-19/h2-3,5,7-9,11,16H,4,6,10,12-14H2,1H3,(H,22,24)