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

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-(4-chlorophenyl)-2-oxoethyl]-triphenylphosphonium bromide IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl]-triphenylphosphanium bromide Traditional Name: [2-(4-chlorophenyl)-2-keto-ethyl]-triphenyl-phosphonium bromide Formula: C26H21BrClOP MolecularWeight: 495.775101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H21ClOP.BrH/c27-22-18-16-21(17-19-22)26(28)20-29(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25;/h1-19H,20H2;1H/q+1;/p-1