N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-6-methylpyridine-3-carboxamide Traditional Name: 6-methyl-N-[2-(piperonylcarbamoyl)phenyl]nicotinamide Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H19N3O4/c1-14-6-8-16(12-23-14)21(26)25-18-5-3-2-4-17(18)22(27)24-11-15-7-9-19-20(10-15)29-13-28-19/h2-10,12H,11,13H2,1H3,(H,24,27)(H,25,26)