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

Systemtic Name: (3-ethoxy-3-oxidanylidene-1-phenyl-propyl)-triphenyl-phosphanium bromide Openeye Name: (3-ethoxy-3-oxo-1-phenyl-propyl)-triphenyl-phosphonium bromide CAS Name: (3-ethoxy-3-oxo-1-phenylpropyl)-triphenylphosphonium bromide IUPAC Name: (3-ethoxy-3-oxo-1-phenylpropyl)-triphenylphosphanium bromide Traditional Name: (3-ethoxy-3-keto-1-phenyl-propyl)-triphenyl-phosphonium bromide Formula: C29H28BrO2P MolecularWeight: 519.409181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28O2P.BrH/c1-2-31-29(30)23-28(24-15-7-3-8-16-24)32(25-17-9-4-10-18-25,26-19-11-5-12-20-26)27-21-13-6-14-22-27;/h3-22,28H,2,23H2,1H3;1H/q+1;/p-1