1-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol iodide

Systemtic Name: 1-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol iodide Openeye Name: 1-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol iodide CAS Name: 1-(2,3-dimethyl-1-benzimidazol-3-iumyl)-3-(4-methoxyphenoxy)-2-propanol iodide IUPAC Name: 1-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol iodide Traditional Name: 1-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-(4-methoxyphenoxy)propan-2-ol iodide Formula: C19H23IN2O3 MolecularWeight: 454.30199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N1CC(COC3=CC=C(C=C3)OC)O)C.[I-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N1CC(COC3=CC=C(C=C3)OC)O)C.[I-]

InChI

InChI=1S/C19H23N2O3.HI/c1-14-20(2)18-6-4-5-7-19(18)21(14)12-15(22)13-24-17-10-8-16(23-3)9-11-17;/h4-11,15,22H,12-13H2,1-3H3;1H/q+1;/p-1