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

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-(4-methoxyphenyl)-2-oxoethyl]-triphenylphosphonium bromide IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl]-triphenylphosphanium bromide Traditional Name: [2-keto-2-(4-methoxyphenyl)ethyl]-triphenyl-phosphonium bromide Formula: C27H24BrO2P MolecularWeight: 491.356021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C27H24O2P.BrH/c1-29-23-19-17-22(18-20-23)27(28)21-30(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26;/h2-20H,21H2,1H3;1H/q+1;/p-1