triphenyl-[[7-(triphenylphosphaniumylmethyl)phenanthren-2-yl]methyl]phosphanium dibromide

Systemtic Name: triphenyl-[[7-(triphenylphosphaniumylmethyl)phenanthren-2-yl]methyl]phosphanium dibromide Openeye Name: triphenyl-[[7-(triphenylphosphaniumylmethyl)-2-phenanthryl]methyl]phosphonium dibromide CAS Name: triphenyl-[[7-(triphenylphosphiniumylmethyl)-2-phenanthrenyl]methyl]phosphonium dibromide IUPAC Name: triphenyl-[[7-(triphenylphosphaniumylmethyl)phenanthren-2-yl]methyl]phosphanium dibromide Traditional Name: triphenyl-[[7-(triphenylphosphiniumylmethyl)-2-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=CC3=C(C=C2)C4=C(C=C3)C=C(C=C4)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=CC3=C(C=C2)C4=C(C=C3)C=C(C=C4)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/c1-7-19-45(20-8-1)53(46-21-9-2-10-22-46,47-23-11-3-12-24-47)39-41-31-35-51-43(37-41)33-34-44-38-42(32-36-52(44)51)40-54(48-25-13-4-14-26-48,49-27-15-5-16-28-49)50-29-17-6-18-30-50;;/h1-38H,39-40H2;2*1H/q+2;;/p-2