N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]quinoline-2-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]quinoline-2-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]quinoline-2-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-2-quinolinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]quinoline-2-carboxamide Traditional Name: N-[2-(piperonylcarbamoyl)phenyl]quinaldamide Formula: C25H19N3O4 MolecularWeight: 425.43606

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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=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H19N3O4/c29-24(26-14-16-9-12-22-23(13-16)32-15-31-22)18-6-2-4-8-20(18)28-25(30)21-11-10-17-5-1-3-7-19(17)27-21/h1-13H,14-15H2,(H,26,29)(H,28,30)