[3-(5-phenoxypentyl)phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [3-(5-phenoxypentyl)phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [3-(5-phenoxypentyl)phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [3-(5-phenoxypentyl)phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [3-(5-phenoxypentyl)phenyl]methyl-triphenylphosphanium bromide Traditional Name: [3-(5-phenoxypentyl)benzyl]-triphenyl-phosphonium bromide Formula: C36H36BrOP MolecularWeight: 595.548201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCCC2=CC(=CC=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)OCCCCCC2=CC(=CC=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C36H36OP.BrH/c1-7-20-33(21-8-1)37-28-15-5-6-17-31-18-16-19-32(29-31)30-38(34-22-9-2-10-23-34,35-24-11-3-12-25-35)36-26-13-4-14-27-36;/h1-4,7-14,16,18-27,29H,5-6,15,17,28,30H2;1H/q+1;/p-1