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

Systemtic Name: 1-(3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)-3-(3-methylphenoxy)propan-2-ol Openeye Name: 1-(3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)-3-(3-methylphenoxy)propan-2-ol CAS Name: 1-(3-ethyl-2-methyl-1-benzimidazol-1-iumyl)-3-(3-methylphenoxy)-2-propanol IUPAC Name: 1-(3-ethyl-2-methylbenzimidazol-1-ium-1-yl)-3-(3-methylphenoxy)propan-2-ol Traditional Name: 1-(3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)-3-(3-methylphenoxy)propan-2-ol Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=CC=CC=C21)CC(COC3=CC=CC(=C3)C)O)C

Isomeric SMILES

CCN1C(=[N+](C2=CC=CC=C21)CC(COC3=CC=CC(=C3)C)O)C

InChI

InChI=1S/C20H25N2O2/c1-4-21-16(3)22(20-11-6-5-10-19(20)21)13-17(23)14-24-18-9-7-8-15(2)12-18/h5-12,17,23H,4,13-14H2,1-3H3/q+1