triphenyl-[[3-(triphenylphosphaniumylmethyl)naphthalen-1-yl]methyl]phosphanium dibromide

Systemtic Name: triphenyl-[[3-(triphenylphosphaniumylmethyl)naphthalen-1-yl]methyl]phosphanium dibromide Openeye Name: triphenyl-[[3-(triphenylphosphaniumylmethyl)-1-naphthyl]methyl]phosphonium dibromide CAS Name: triphenyl-[[3-(triphenylphosphiniumylmethyl)-1-naphthalenyl]methyl]phosphonium dibromide IUPAC Name: triphenyl-[[3-(triphenylphosphaniumylmethyl)naphthalen-1-yl]methyl]phosphanium dibromide Traditional Name: triphenyl-[[3-(triphenylphosphiniumylmethyl)-1-naphthyl]methyl]phosphonium dibromide Formula: C48H40Br2P2 MolecularWeight: 838.586722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC3=CC=CC=C3C(=C2)C[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(=C2)C[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/c1-7-22-42(23-8-1)49(43-24-9-2-10-25-43,44-26-11-3-12-27-44)37-39-35-40-21-19-20-34-48(40)41(36-39)38-50(45-28-13-4-14-29-45,46-30-15-5-16-31-46)47-32-17-6-18-33-47;;/h1-36H,37-38H2;2*1H/q+2;;/p-2