[5-oxidanylidene-4-(phenylmethylidene)oxolan-3-yl]-triphenyl-phosphanium bromide

Systemtic Name: [5-oxidanylidene-4-(phenylmethylidene)oxolan-3-yl]-triphenyl-phosphanium bromide Openeye Name: (4-benzylidene-5-oxo-tetrahydrofuran-3-yl)-triphenyl-phosphonium bromide CAS Name: [5-oxo-4-(phenylmethylene)-3-oxolanyl]-triphenylphosphonium bromide IUPAC Name: (4-benzylidene-5-oxooxolan-3-yl)-triphenylphosphanium bromide Traditional Name: (4-benzal-5-keto-tetrahydrofuran-3-yl)-triphenyl-phosphonium bromide Formula: C29H24BrO2P MolecularWeight: 515.377421

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=CC2=CC=CC=C2)C(=O)O1)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1C(C(=CC2=CC=CC=C2)C(=O)O1)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C29H24O2P.BrH/c30-29-27(21-23-13-5-1-6-14-23)28(22-31-29)32(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26;/h1-21,28H,22H2;1H/q+1;/p-1