(4-ethoxy-4-oxidanylidene-butyl)-triphenyl-phosphanium bromide

Systemtic Name: (4-ethoxy-4-oxidanylidene-butyl)-triphenyl-phosphanium bromide Openeye Name: (4-ethoxy-4-oxo-butyl)-triphenyl-phosphonium bromide CAS Name: (4-ethoxy-4-oxobutyl)-triphenylphosphonium bromide IUPAC Name: (4-ethoxy-4-oxobutyl)-triphenylphosphanium bromide Traditional Name: (4-ethoxy-4-keto-butyl)-triphenyl-phosphonium bromide Formula: C24H26BrO2P MolecularWeight: 457.339801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26O2P.BrH/c1-2-26-24(25)19-12-20-27(21-13-6-3-7-14-21,22-15-8-4-9-16-22)23-17-10-5-11-18-23;/h3-11,13-18H,2,12,19-20H2,1H3;1H/q+1;/p-1