2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,6-dimethyl-pyridine-3-carboxamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,6-dimethyl-pyridine-3-carboxamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,6-dimethyl-pyridine-3-carboxamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4,6-dimethyl-3-pyridinecarboxamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carboxamide Traditional Name: 4,6-dimethyl-2-(4-piperonylpiperazino)nicotinamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)N)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)N)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C20H24N4O3/c1-13-9-14(2)22-20(18(13)19(21)25)24-7-5-23(6-8-24)11-15-3-4-16-17(10-15)27-12-26-16/h3-4,9-10H,5-8,11-12H2,1-2H3,(H2,21,25)