[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-triphenyl-phosphanium bromide

Systemtic Name: [(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-triphenyl-phosphanium bromide Openeye Name: [(1Z)-1-[ethoxy(hydroxy)methylene]-2-oxo-propyl]-triphenyl-phosphonium bromide CAS Name: [(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-triphenylphosphonium bromide IUPAC Name: [(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-triphenylphosphanium bromide Traditional Name: [(Z)-1-acetyl-2-ethoxy-2-hydroxy-vinyl]-triphenyl-phosphonium bromide Formula: C24H24BrO3P MolecularWeight: 471.323321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23O3P.BrH/c1-3-27-24(26)23(19(2)25)28(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,3H2,1-2H3;1H