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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC1=[N+](C2=CC=CC=C2N1C[C@H](COC3=CC=CC(=C3)C)O)C

InChI

InChI=1S/C20H25N2O2/c1-4-20-21(3)18-10-5-6-11-19(18)22(20)13-16(23)14-24-17-9-7-8-15(2)12-17/h5-12,16,23H,4,13-14H2,1-3H3/q+1/t16-/m1/s1