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

Systemtic Name: 2-[1-(dodecoxymethyl)-3-phenyl-benzimidazol-1-ium-2-yl]-1,1-diphenyl-ethanol Openeye Name: 2-[1-(dodecoxymethyl)-3-phenyl-benzimidazol-1-ium-2-yl]-1,1-diphenyl-ethanol CAS Name: 2-[1-(dodecoxymethyl)-3-phenyl-2-benzimidazol-1-iumyl]-1,1-diphenylethanol IUPAC Name: 2-[1-(dodecoxymethyl)-3-phenylbenzimidazol-1-ium-2-yl]-1,1-diphenylethanol Traditional Name: 2-[1-(lauryloxymethyl)-3-phenyl-benzimidazol-1-ium-2-yl]-1,1-diphenyl-ethanol Formula: C40H49N2O2+ MolecularWeight: 589.82926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC[N+]1=C(N(C2=CC=CC=C21)C3=CC=CC=C3)CC(C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

CCCCCCCCCCCCOC[N+]1=C(N(C2=CC=CC=C21)C3=CC=CC=C3)CC(C4=CC=CC=C4)(C5=CC=CC=C5)O

InChI

InChI=1S/C40H49N2O2/c1-2-3-4-5-6-7-8-9-10-22-31-44-33-41-37-29-20-21-30-38(37)42(36-27-18-13-19-28-36)39(41)32-40(43,34-23-14-11-15-24-34)35-25-16-12-17-26-35/h11-21,23-30,43H,2-10,22,31-33H2,1H3/q+1