[4,8-dihexoxy-5-(triphenylphosphaniumylmethyl)naphthalen-1-yl]methyl-triphenyl-phosphanium dibromide

Systemtic Name: [4,8-dihexoxy-5-(triphenylphosphaniumylmethyl)naphthalen-1-yl]methyl-triphenyl-phosphanium dibromide Openeye Name: [4,8-dihexoxy-5-(triphenylphosphaniumylmethyl)-1-naphthyl]methyl-triphenyl-phosphonium dibromide CAS Name: [4,8-dihexoxy-5-(triphenylphosphiniumylmethyl)-1-naphthalenyl]methyl-triphenylphosphonium dibromide IUPAC Name: [4,8-dihexoxy-5-(triphenylphosphaniumylmethyl)naphthalen-1-yl]methyl-triphenylphosphanium dibromide Traditional Name: [4,8-dihexoxy-5-(triphenylphosphiniumylmethyl)-1-naphthyl]methyl-triphenyl-phosphonium dibromide Formula: C60H64Br2O2P2 MolecularWeight: 1038.904482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C2C(=CC=C(C2=C(C=C1)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)OCCCCCC)C[P+](C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.[Br-].[Br-]

Isomeric SMILES

CCCCCCOC1=C2C(=CC=C(C2=C(C=C1)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)OCCCCCC)C[P+](C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.[Br-].[Br-]

InChI

InChI=1S/C60H64O2P2.2BrH/c1-3-5-7-27-45-61-57-43-41-50(48-64(54-35-21-12-22-36-54,55-37-23-13-24-38-55)56-39-25-14-26-40-56)60-58(62-46-28-8-6-4-2)44-42-49(59(57)60)47-63(51-29-15-9-16-30-51,52-31-17-10-18-32-52)53-33-19-11-20-34-53;;/h9-26,29-44H,3-8,27-28,45-48H2,1-2H3;2*1H/q+2;;/p-2