2-[1-(dodecoxymethyl)-3-methyl-benzimidazol-3-ium-2-yl]-1,1-diphenyl-ethanol chloride

Systemtic Name: 2-[1-(dodecoxymethyl)-3-methyl-benzimidazol-3-ium-2-yl]-1,1-diphenyl-ethanol chloride Openeye Name: 2-[1-(dodecoxymethyl)-3-methyl-benzimidazol-3-ium-2-yl]-1,1-diphenyl-ethanol chloride CAS Name: 2-[1-(dodecoxymethyl)-3-methyl-2-benzimidazol-3-iumyl]-1,1-diphenylethanol chloride IUPAC Name: 2-[1-(dodecoxymethyl)-3-methylbenzimidazol-3-ium-2-yl]-1,1-diphenylethanol chloride Traditional Name: 2-[1-(lauryloxymethyl)-3-methyl-benzimidazol-3-ium-2-yl]-1,1-diphenyl-ethanol chloride Formula: C35H47ClN2O2 MolecularWeight: 563.21288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1CC(C3=CC=CC=C3)(C4=CC=CC=C4)O)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCOCN1C2=CC=CC=C2[N+](=C1CC(C3=CC=CC=C3)(C4=CC=CC=C4)O)C.[Cl-]

InChI

InChI=1S/C35H47N2O2.ClH/c1-3-4-5-6-7-8-9-10-11-20-27-39-29-37-33-26-19-18-25-32(33)36(2)34(37)28-35(38,30-21-14-12-15-22-30)31-23-16-13-17-24-31;/h12-19,21-26,38H,3-11,20,27-29H2,1-2H3;1H/q+1;/p-1