(3-oxidanyl-3-oxidanylidene-1-phenyl-propyl)-triphenyl-phosphanium bromide

Systemtic Name: (3-oxidanyl-3-oxidanylidene-1-phenyl-propyl)-triphenyl-phosphanium bromide Openeye Name: (3-hydroxy-3-oxo-1-phenyl-propyl)-triphenyl-phosphonium bromide CAS Name: (3-hydroxy-3-oxo-1-phenylpropyl)-triphenylphosphonium bromide IUPAC Name: (3-hydroxy-3-oxo-1-phenylpropyl)-triphenylphosphanium bromide Traditional Name: (3-hydroxy-3-keto-1-phenyl-propyl)-triphenyl-phosphonium bromide Formula: C27H24BrO2P MolecularWeight: 491.356021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H23O2P.BrH/c28-27(29)21-26(22-13-5-1-6-14-22)30(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-20,26H,21H2;1H