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

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-2,6-dimethyl-quinoline-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-2,6-dimethyl-quinoline-3-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-2,6-dimethyl-3-quinolinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-2,6-dimethylquinoline-3-carboxamide Traditional Name: 2,6-dimethyl-N-[2-(piperonylcarbamoyl)phenyl]quinoline-3-carboxamide Formula: C27H23N3O4 MolecularWeight: 453.48922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H23N3O4/c1-16-7-9-22-19(11-16)13-21(17(2)29-22)27(32)30-23-6-4-3-5-20(23)26(31)28-14-18-8-10-24-25(12-18)34-15-33-24/h3-13H,14-15H2,1-2H3,(H,28,31)(H,30,32)