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

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-6-chloranyl-pyridine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-6-chloro-pyridine-3-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-6-chloro-3-pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-6-chloropyridine-3-carboxamide Traditional Name: 6-chloro-N-[2-(piperonylcarbamoyl)phenyl]nicotinamide Formula: C21H16ClN3O4 MolecularWeight: 409.82244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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