[(E)-5-oxidanyl-5-oxidanylidene-pent-2-enyl]-triphenyl-phosphanium bromide

Systemtic Name: [(E)-5-oxidanyl-5-oxidanylidene-pent-2-enyl]-triphenyl-phosphanium bromide Openeye Name: [(E)-5-hydroxy-5-oxo-pent-2-enyl]-triphenyl-phosphonium bromide CAS Name: [(E)-5-hydroxy-5-oxopent-2-enyl]-triphenylphosphonium bromide IUPAC Name: [(E)-5-hydroxy-5-oxopent-2-enyl]-triphenylphosphanium bromide Traditional Name: [(E)-5-hydroxy-5-keto-pent-2-enyl]-triphenyl-phosphonium bromide Formula: C23H22BrO2P MolecularWeight: 441.297341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21O2P.BrH/c24-23(25)18-10-11-19-26(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-17H,18-19H2;1H/b11-10+;