[2-(1-methylbenzimidazol-2-yl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide

Systemtic Name: [2-(1-methylbenzimidazol-2-yl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-(1-methylbenzimidazol-2-yl)-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-(1-methyl-2-benzimidazolyl)-2-oxoethyl]-triphenylphosphonium bromide IUPAC Name: [2-(1-methylbenzimidazol-2-yl)-2-oxoethyl]-triphenylphosphanium bromide Traditional Name: [2-keto-2-(1-methylbenzimidazol-2-yl)ethyl]-triphenyl-phosphonium bromide Formula: C28H24BrN2OP MolecularWeight: 515.380721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=O)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C(=O)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C28H24N2OP.BrH/c1-30-26-20-12-11-19-25(26)29-28(30)27(31)21-32(22-13-5-2-6-14-22,23-15-7-3-8-16-23)24-17-9-4-10-18-24;/h2-20H,21H2,1H3;1H/q+1;/p-1