triphenyl(3-triphenylphosphaniumylprop-1-enyl)phosphanium dibromide

Systemtic Name: triphenyl(3-triphenylphosphaniumylprop-1-enyl)phosphanium dibromide Openeye Name: triphenyl(3-triphenylphosphaniumylallyl)phosphonium dibromide CAS Name: triphenyl(3-triphenylphosphiniumylprop-1-enyl)phosphonium dibromide IUPAC Name: triphenyl(3-triphenylphosphaniumylprop-1-enyl)phosphanium dibromide Traditional Name: triphenyl(3-triphenylphosphiniumylallyl)phosphonium dibromide Formula: C39H34Br2P2 MolecularWeight: 724.442782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-].[Br-]

InChI

InChI=1S/C39H34P2.2BrH/c1-7-20-34(21-8-1)40(35-22-9-2-10-23-35,36-24-11-3-12-25-36)32-19-33-41(37-26-13-4-14-27-37,38-28-15-5-16-29-38)39-30-17-6-18-31-39;;/h1-32H,33H2;2*1H/q+2;;/p-2