(4-methyl-5-oxidanyl-5-oxidanylidene-pentyl)-triphenyl-phosphanium bromide

Systemtic Name: (4-methyl-5-oxidanyl-5-oxidanylidene-pentyl)-triphenyl-phosphanium bromide Openeye Name: (5-hydroxy-4-methyl-5-oxo-pentyl)-triphenyl-phosphonium bromide CAS Name: (5-hydroxy-4-methyl-5-oxopentyl)-triphenylphosphonium bromide IUPAC Name: (5-hydroxy-4-methyl-5-oxopentyl)-triphenylphosphanium bromide Traditional Name: (5-hydroxy-5-keto-4-methyl-pentyl)-triphenyl-phosphonium bromide Formula: C24H26BrO2P MolecularWeight: 457.339801

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25O2P.BrH/c1-20(24(25)26)12-11-19-27(21-13-5-2-6-14-21,22-15-7-3-8-16-22)23-17-9-4-10-18-23;/h2-10,13-18,20H,11-12,19H2,1H3;1H