[2-(4-acetamidophenyl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide

Systemtic Name: [2-(4-acetamidophenyl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-(4-acetamidophenyl)-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-(4-acetamidophenyl)-2-oxoethyl]-triphenylphosphonium bromide IUPAC Name: [2-(4-acetamidophenyl)-2-oxoethyl]-triphenylphosphanium bromide Traditional Name: [2-(4-acetamidophenyl)-2-keto-ethyl]-triphenyl-phosphonium bromide Formula: C28H25BrNO2P MolecularWeight: 518.381361

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C28H24NO2P.BrH/c1-22(30)29-24-19-17-23(18-20-24)28(31)21-32(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27;/h2-20H,21H2,1H3;1H