1-(2,3-diethylbenzimidazol-1-ium-1-yl)-3-(4-methylphenoxy)propan-2-ol

Systemtic Name: 1-(2,3-diethylbenzimidazol-1-ium-1-yl)-3-(4-methylphenoxy)propan-2-ol Openeye Name: 1-(2,3-diethylbenzimidazol-1-ium-1-yl)-3-(4-methylphenoxy)propan-2-ol CAS Name: 1-(2,3-diethyl-1-benzimidazol-1-iumyl)-3-(4-methylphenoxy)-2-propanol IUPAC Name: 1-(2,3-diethylbenzimidazol-1-ium-1-yl)-3-(4-methylphenoxy)propan-2-ol Traditional Name: 1-(2,3-diethylbenzimidazol-1-ium-1-yl)-3-(4-methylphenoxy)propan-2-ol Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C2=CC=CC=C2N1CC)CC(COC3=CC=C(C=C3)C)O

Isomeric SMILES

CCC1=[N+](C2=CC=CC=C2N1CC)CC(COC3=CC=C(C=C3)C)O

InChI

InChI=1S/C21H27N2O2/c1-4-21-22(5-2)19-8-6-7-9-20(19)23(21)14-17(24)15-25-18-12-10-16(3)11-13-18/h6-13,17,24H,4-5,14-15H2,1-3H3/q+1