1-[2-(2-diphenylphosphanylphenyl)-3a,4,5,6,7,7a-hexahydrobenzimidazol-1-yl]ethanone

Systemtic Name: 1-[2-(2-diphenylphosphanylphenyl)-3a,4,5,6,7,7a-hexahydrobenzimidazol-1-yl]ethanone Openeye Name: 1-[2-(2-diphenylphosphanylphenyl)-3a,4,5,6,7,7a-hexahydrobenzimidazol-1-yl]ethanone CAS Name: 1-[2-(2-diphenylphosphinophenyl)-3a,4,5,6,7,7a-hexahydrobenzimidazol-1-yl]ethanone IUPAC Name: 1-[2-(2-diphenylphosphanylphenyl)-3a,4,5,6,7,7a-hexahydrobenzimidazol-1-yl]ethanone Traditional Name: 1-[2-(2-diphenylphosphinophenyl)-3a,4,5,6,7,7a-hexahydrobenzimidazol-1-yl]ethanone Formula: C27H27N2OP MolecularWeight: 426.489841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2CCCCC2N=C1C3=CC=CC=C3P(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)N1C2CCCCC2N=C1C3=CC=CC=C3P(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N2OP/c1-20(30)29-25-18-10-9-17-24(25)28-27(29)23-16-8-11-19-26(23)31(21-12-4-2-5-13-21)22-14-6-3-7-15-22/h2-8,11-16,19,24-25H,9-10,17-18H2,1H3