[6,7-bis(fluoranyl)quinolin-2-yl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [6,7-bis(fluoranyl)quinolin-2-yl]methyl-triphenyl-phosphanium bromide Openeye Name: (6,7-difluoro-2-quinolyl)methyl-triphenyl-phosphonium bromide CAS Name: (6,7-difluoro-2-quinolinyl)methyl-triphenylphosphonium bromide IUPAC Name: (6,7-difluoroquinolin-2-yl)methyl-triphenylphosphanium bromide Traditional Name: (6,7-difluoro-2-quinolyl)methyl-triphenyl-phosphonium bromide Formula: C28H21BrF2NP MolecularWeight: 520.347607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=NC3=CC(=C(C=C3C=C2)F)F)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=NC3=CC(=C(C=C3C=C2)F)F)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C28H21F2NP.BrH/c29-26-18-21-16-17-22(31-28(21)19-27(26)30)20-32(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25;/h1-19H,20H2;1H/q+1;/p-1