N-(1,3-benzodioxol-5-ylmethyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(3-methyl-1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide Traditional Name: 6-(3-methylpiperazino)-N-piperonyl-nicotinamide Formula: C19H22N4O3 MolecularWeight: 354.40298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=NC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1CN(CCN1)C2=NC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H22N4O3/c1-13-11-23(7-6-20-13)18-5-3-15(10-21-18)19(24)22-9-14-2-4-16-17(8-14)26-12-25-16/h2-5,8,10,13,20H,6-7,9,11-12H2,1H3,(H,22,24)