2-(1,3-benzodioxol-5-yl)-N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(2-bromo-4,6-difluoro-phenyl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(2-bromo-4,6-difluorophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(2-bromo-4,6-difluorophenyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(2-bromo-4,6-difluoro-phenyl)cinchoninamide Formula: C23H13BrF2N2O3 MolecularWeight: 483.261726

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=C(C=C(C=C5Br)F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=C(C=C(C=C5Br)F)F

InChI

InChI=1S/C23H13BrF2N2O3/c24-16-8-13(25)9-17(26)22(16)28-23(29)15-10-19(27-18-4-2-1-3-14(15)18)12-5-6-20-21(7-12)31-11-30-20/h1-10H,11H2,(H,28,29)