triphenyl-[[10-(triphenylphosphaniumylmethyl)phenanthren-9-yl]methyl]phosphanium dibromide

Systemtic Name: triphenyl-[[10-(triphenylphosphaniumylmethyl)phenanthren-9-yl]methyl]phosphanium dibromide Openeye Name: triphenyl-[[10-(triphenylphosphaniumylmethyl)-9-phenanthryl]methyl]phosphonium dibromide CAS Name: triphenyl-[[10-(triphenylphosphiniumylmethyl)-9-phenanthrenyl]methyl]phosphonium dibromide IUPAC Name: triphenyl-[[10-(triphenylphosphaniumylmethyl)phenanthren-9-yl]methyl]phosphanium dibromide Traditional Name: triphenyl-[[10-(triphenylphosphiniumylmethyl)-9-phenanthryl]methyl]phosphonium dibromide Formula: C52H42Br2P2 MolecularWeight: 888.645402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=C(C3=CC=CC=C3C4=CC=CC=C42)C[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9.[Br-].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=C(C3=CC=CC=C3C4=CC=CC=C42)C[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9.[Br-].[Br-]

InChI

InChI=1S/C52H42P2.2BrH/c1-7-23-41(24-8-1)53(42-25-9-2-10-26-42,43-27-11-3-12-28-43)39-51-49-37-21-19-35-47(49)48-36-20-22-38-50(48)52(51)40-54(44-29-13-4-14-30-44,45-31-15-5-16-32-45)46-33-17-6-18-34-46;;/h1-38H,39-40H2;2*1H/q+2;;/p-2