triphenyl-[[3-(triphenylphosphaniumylmethyl)naphthalen-2-yl]methyl]phosphanium dibromide

Systemtic Name: triphenyl-[[3-(triphenylphosphaniumylmethyl)naphthalen-2-yl]methyl]phosphanium dibromide Openeye Name: triphenyl-[[3-(triphenylphosphaniumylmethyl)-2-naphthyl]methyl]phosphonium dibromide CAS Name: triphenyl-[[3-(triphenylphosphiniumylmethyl)-2-naphthalenyl]methyl]phosphonium dibromide IUPAC Name: triphenyl-[[3-(triphenylphosphaniumylmethyl)naphthalen-2-yl]methyl]phosphanium dibromide Traditional Name: triphenyl-[[3-(triphenylphosphiniumylmethyl)-2-naphthyl]methyl]phosphonium dibromide Formula: C48H40Br2P2 MolecularWeight: 838.586722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC3=CC=CC=C3C=C2C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.[Br-].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC3=CC=CC=C3C=C2C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.[Br-].[Br-]

InChI

InChI=1S/C48H40P2.2BrH/c1-7-23-43(24-8-1)49(44-25-9-2-10-26-44,45-27-11-3-12-28-45)37-41-35-39-21-19-20-22-40(39)36-42(41)38-50(46-29-13-4-14-30-46,47-31-15-5-16-32-47)48-33-17-6-18-34-48;;/h1-36H,37-38H2;2*1H/q+2;;/p-2