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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(2-phenoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(2-phenoxyphenyl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(2-phenoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(2-phenoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(2-phenoxyphenyl)cinchoninamide Formula: C29H20N2O4 MolecularWeight: 460.4801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=CC=C5OC6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=CC=C5OC6=CC=CC=C6

InChI

InChI=1S/C29H20N2O4/c32-29(31-24-12-6-7-13-26(24)35-20-8-2-1-3-9-20)22-17-25(30-23-11-5-4-10-21(22)23)19-14-15-27-28(16-19)34-18-33-27/h1-17H,18H2,(H,31,32)