[4-[3,4-bis(fluoranyl)phenyl]phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [4-[3,4-bis(fluoranyl)phenyl]phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [4-(3,4-difluorophenyl)phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [4-(3,4-difluorophenyl)phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [4-(3,4-difluorophenyl)phenyl]methyl-triphenylphosphanium bromide Traditional Name: [4-(3,4-difluorophenyl)benzyl]-triphenyl-phosphonium bromide Formula: C31H24BrF2P MolecularWeight: 545.396827

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)C3=CC(=C(C=C3)F)F)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)C3=CC(=C(C=C3)F)F)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C31H24F2P.BrH/c32-30-21-20-26(22-31(30)33)25-18-16-24(17-19-25)23-34(27-10-4-1-5-11-27,28-12-6-2-7-13-28)29-14-8-3-9-15-29;/h1-22H,23H2;1H/q+1;/p-1