[2-bromanyl-1-ethoxy-1,3-bis(oxidanylidene)butan-2-yl]-triphenyl-phosphanium chloride

Systemtic Name: [2-bromanyl-1-ethoxy-1,3-bis(oxidanylidene)butan-2-yl]-triphenyl-phosphanium chloride Openeye Name: (1-bromo-1-ethoxycarbonyl-2-oxo-propyl)-triphenyl-phosphonium chloride CAS Name: (2-bromo-1-ethoxy-1,3-dioxobutan-2-yl)-triphenylphosphonium chloride IUPAC Name: (2-bromo-1-ethoxy-1,3-dioxobutan-2-yl)-triphenylphosphanium chloride Traditional Name: (1-bromo-1-carbethoxy-2-keto-propyl)-triphenyl-phosphonium chloride Formula: C24H23BrClO3P MolecularWeight: 505.768381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23BrO3P.ClH/c1-3-28-23(27)24(25,19(2)26)29(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/q+1;/p-1