N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-2-chloranyl-pyridine-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-2-chloranyl-pyridine-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-2-chloro-pyridine-4-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-2-chloro-4-pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-2-chloropyridine-4-carboxamide Traditional Name: 2-chloro-N-[2-(piperonylcarbamoyl)phenyl]isonicotinamide Formula: C21H16ClN3O4 MolecularWeight: 409.82244

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)C4=CC(=NC=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)C4=CC(=NC=C4)Cl

InChI

InChI=1S/C21H16ClN3O4/c22-19-10-14(7-8-23-19)20(26)25-16-4-2-1-3-15(16)21(27)24-11-13-5-6-17-18(9-13)29-12-28-17/h1-10H,11-12H2,(H,24,27)(H,25,26)