2-(1,3-benzodioxol-5-yl)-N-(2,4-dimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(2,4-dimethoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(2,4-dimethoxyphenyl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(2,4-dimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(2,4-dimethoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(2,4-dimethoxyphenyl)cinchoninamide Formula: C25H20N2O5 MolecularWeight: 428.4367

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C25H20N2O5/c1-29-16-8-9-20(23(12-16)30-2)27-25(28)18-13-21(26-19-6-4-3-5-17(18)19)15-7-10-22-24(11-15)32-14-31-22/h3-13H,14H2,1-2H3,(H,27,28)