(5-oxidanyl-5-oxidanylidene-pent-3-ynyl)-triphenyl-phosphanium bromide

Systemtic Name: (5-oxidanyl-5-oxidanylidene-pent-3-ynyl)-triphenyl-phosphanium bromide Openeye Name: (5-hydroxy-5-oxo-pent-3-ynyl)-triphenyl-phosphonium bromide CAS Name: (5-hydroxy-5-oxopent-3-ynyl)-triphenylphosphonium bromide IUPAC Name: (5-hydroxy-5-oxopent-3-ynyl)-triphenylphosphanium bromide Traditional Name: (5-hydroxy-5-keto-pent-3-ynyl)-triphenyl-phosphonium bromide Formula: C23H20BrO2P MolecularWeight: 439.281461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19O2P.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;/h1-9,12-17H,11,19H2;1H