N-(1,3-benzodioxol-5-ylmethyl)-1-(5-cyanopyridin-2-yl)-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-cyanopyridin-2-yl)-N-methyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-cyano-2-pyridyl)-N-methyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-cyano-2-pyridinyl)-N-methyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-cyanopyridin-2-yl)-N-methylpiperidine-4-carboxamide Traditional Name: 1-(5-cyano-2-pyridyl)-N-methyl-N-piperonyl-isonipecotamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C21H22N4O3/c1-24(13-15-2-4-18-19(10-15)28-14-27-18)21(26)17-6-8-25(9-7-17)20-5-3-16(11-22)12-23-20/h2-5,10,12,17H,6-9,13-14H2,1H3