[(E)-4-ethoxy-3-methyl-4-oxidanylidene-but-2-enyl]-triphenyl-phosphanium chloride

Systemtic Name: [(E)-4-ethoxy-3-methyl-4-oxidanylidene-but-2-enyl]-triphenyl-phosphanium chloride Openeye Name: [(E)-4-ethoxy-3-methyl-4-oxo-but-2-enyl]-triphenyl-phosphonium chloride CAS Name: [(E)-4-ethoxy-3-methyl-4-oxobut-2-enyl]-triphenylphosphonium chloride IUPAC Name: [(E)-4-ethoxy-3-methyl-4-oxobut-2-enyl]-triphenylphosphanium chloride Traditional Name: [(E)-4-ethoxy-4-keto-3-methyl-but-2-enyl]-triphenyl-phosphonium chloride Formula: C25H26ClO2P MolecularWeight: 424.899501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26O2P.ClH/c1-3-27-25(26)21(2)19-20-28(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+;