[3-(2-methoxy-2-oxidanylidene-ethyl)phenyl]-diphenyl-(phenylmethyl)phosphanium bromide

Systemtic Name: [3-(2-methoxy-2-oxidanylidene-ethyl)phenyl]-diphenyl-(phenylmethyl)phosphanium bromide Openeye Name: benzyl-[3-(2-methoxy-2-oxo-ethyl)phenyl]-diphenyl-phosphonium bromide CAS Name: [3-(2-methoxy-2-oxoethyl)phenyl]-diphenyl-(phenylmethyl)phosphonium bromide IUPAC Name: benzyl-[3-(2-methoxy-2-oxoethyl)phenyl]-diphenylphosphanium bromide Traditional Name: benzyl-[3-(2-keto-2-methoxy-ethyl)phenyl]-diphenyl-phosphonium bromide Formula: C28H26BrO2P MolecularWeight: 505.382601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=CC=C1)[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC(=O)CC1=CC(=CC=C1)[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C28H26O2P.BrH/c1-30-28(29)21-24-14-11-19-27(20-24)31(25-15-7-3-8-16-25,26-17-9-4-10-18-26)22-23-12-5-2-6-13-23;/h2-20H,21-22H2,1H3;1H/q+1;/p-1