[(E)-3-oxidanylidenebut-1-enyl]-triphenyl-phosphanium bromide

Systemtic Name: [(E)-3-oxidanylidenebut-1-enyl]-triphenyl-phosphanium bromide Openeye Name: [(E)-3-oxobut-1-enyl]-triphenyl-phosphonium bromide CAS Name: [(E)-3-oxobut-1-enyl]-triphenylphosphonium bromide IUPAC Name: [(E)-3-oxobut-1-enyl]-triphenylphosphanium bromide Traditional Name: [(E)-3-ketobut-1-enyl]-triphenyl-phosphonium bromide Formula: C22H20BrOP MolecularWeight: 411.271361

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20OP.BrH/c1-19(23)17-18-24(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22;/h2-18H,1H3;1H/q+1;/p-1/b18-17+;