[(Z)-4-ethoxy-2-methyl-4-oxidanylidene-but-2-enyl]-triphenyl-phosphanium bromide

Systemtic Name: [(Z)-4-ethoxy-2-methyl-4-oxidanylidene-but-2-enyl]-triphenyl-phosphanium bromide Openeye Name: [(Z)-4-ethoxy-2-methyl-4-oxo-but-2-enyl]-triphenyl-phosphonium bromide CAS Name: [(Z)-4-ethoxy-2-methyl-4-oxobut-2-enyl]-triphenylphosphonium bromide IUPAC Name: [(Z)-4-ethoxy-2-methyl-4-oxobut-2-enyl]-triphenylphosphanium bromide Traditional Name: [(Z)-4-ethoxy-4-keto-2-methyl-but-2-enyl]-triphenyl-phosphonium bromide Formula: C25H26BrO2P MolecularWeight: 469.350501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26O2P.BrH/c1-3-27-25(26)19-21(2)20-28(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24;/h4-19H,3,20H2,1-2H3;1H/q+1;/p-1/b21-19-;