N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-methyl-N-piperonyl-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H23N3O5S/c1-22(13-15-4-5-18-19(11-15)28-14-27-18)20(24)16-6-9-23(10-7-16)29(25,26)17-3-2-8-21-12-17/h2-5,8,11-12,16H,6-7,9-10,13-14H2,1H3