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

Systemtic Name: 1-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)-3-phenylmethoxy-propan-2-ol iodide Openeye Name: 1-benzyloxy-3-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)propan-2-ol iodide CAS Name: 1-(2-ethyl-3-methyl-1-benzimidazol-3-iumyl)-3-phenylmethoxy-2-propanol iodide IUPAC Name: 1-(2-ethyl-3-methylbenzimidazol-3-ium-1-yl)-3-phenylmethoxypropan-2-ol iodide Traditional Name: 1-benzoxy-3-(2-ethyl-3-methyl-benzimidazol-3-ium-1-yl)propan-2-ol iodide Formula: C20H25IN2O2 MolecularWeight: 452.32917

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C2=CC=CC=C2N1CC(COCC3=CC=CC=C3)O)C.[I-]

Isomeric SMILES

CCC1=[N+](C2=CC=CC=C2N1CC(COCC3=CC=CC=C3)O)C.[I-]

InChI

InChI=1S/C20H25N2O2.HI/c1-3-20-21(2)18-11-7-8-12-19(18)22(20)13-17(23)15-24-14-16-9-5-4-6-10-16;/h4-12,17,23H,3,13-15H2,1-2H3;1H/q+1;/p-1