(3-bromanyl-2-oxidanylidene-butyl)-triphenyl-phosphanium bromide

Systemtic Name: (3-bromanyl-2-oxidanylidene-butyl)-triphenyl-phosphanium bromide Openeye Name: (3-bromo-2-oxo-butyl)-triphenyl-phosphonium bromide CAS Name: (3-bromo-2-oxobutyl)-triphenylphosphonium bromide IUPAC Name: (3-bromo-2-oxobutyl)-triphenylphosphanium bromide Traditional Name: (3-bromo-2-keto-butyl)-triphenyl-phosphonium bromide Formula: C22H21Br2OP MolecularWeight: 492.183301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrOP.BrH/c1-18(23)22(24)17-25(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21;/h2-16,18H,17H2,1H3;1H/q+1;/p-1