1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol

Systemtic Name: 1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol Openeye Name: 1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol CAS Name: 1-(2-ethyl-3-methyl-1-benzimidazol-3-iumyl)-3-(4-methoxyphenoxy)-2-propanol IUPAC Name: 1-(2-ethyl-3-methylbenzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol Traditional Name: 1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N2O3/c1-4-20-21(2)18-7-5-6-8-19(18)22(20)13-15(23)14-25-17-11-9-16(24-3)10-12-17/h5-12,15,23H,4,13-14H2,1-3H3/q+1