[(E)-4-oxidanylidenebut-2-enyl]-triphenyl-phosphanium bromide

Systemtic Name: [(E)-4-oxidanylidenebut-2-enyl]-triphenyl-phosphanium bromide Openeye Name: [(E)-4-oxobut-2-enyl]-triphenyl-phosphonium bromide CAS Name: [(E)-4-oxobut-2-enyl]-triphenylphosphonium bromide IUPAC Name: [(E)-4-oxobut-2-enyl]-triphenylphosphanium bromide Traditional Name: [(E)-4-ketobut-2-enyl]-triphenyl-phosphonium bromide Formula: C22H20BrOP MolecularWeight: 411.271361

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20OP.BrH/c23-18-10-11-19-24(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-18H,19H2;1H/q+1;/p-1/b11-10+;