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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxidanylidene-piperazin-1-yl]-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxo-piperazin-1-yl]-6-methyl-pyridine-3-carboxamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxo-1-piperazinyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxopiperazin-1-yl]-6-methylpyridine-3-carboxamide Traditional Name: 2-(3-keto-4-piperonyl-piperazino)-6-methyl-nicotinamide Formula: C19H20N4O4 MolecularWeight: 368.3865

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N)N2CCN(C(=O)C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N)N2CCN(C(=O)C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H20N4O4/c1-12-2-4-14(18(20)25)19(21-12)23-7-6-22(17(24)10-23)9-13-3-5-15-16(8-13)27-11-26-15/h2-5,8H,6-7,9-11H2,1H3,(H2,20,25)