(8-oxidanyl-8-oxidanylidene-octyl)-triphenyl-phosphanium bromide

Systemtic Name: (8-oxidanyl-8-oxidanylidene-octyl)-triphenyl-phosphanium bromide Openeye Name: (8-hydroxy-8-oxo-octyl)-triphenyl-phosphonium bromide CAS Name: (8-hydroxy-8-oxooctyl)-triphenylphosphonium bromide IUPAC Name: (8-hydroxy-8-oxooctyl)-triphenylphosphanium bromide Traditional Name: (8-hydroxy-8-keto-octyl)-triphenyl-phosphonium bromide Formula: C26H30BrO2P MolecularWeight: 485.392961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCCCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCCCCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C26H29O2P.BrH/c27-26(28)21-13-2-1-3-14-22-29(23-15-7-4-8-16-23,24-17-9-5-10-18-24)25-19-11-6-12-20-25;/h4-12,15-20H,1-3,13-14,21-22H2;1H