N-(2,5-dimethoxyphenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)ethanamide iodide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)ethanamide iodide Openeye Name: N-(2,5-dimethoxyphenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)acetamide iodide CAS Name: N-(2,5-dimethoxyphenyl)-2-(3-methyl-1-benzimidazol-3-iumyl)acetamide iodide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)acetamide iodide Traditional Name: N-(2,5-dimethoxyphenyl)-2-(3-methylbenzimidazol-3-ium-1-yl)acetamide iodide Formula: C18H20IN3O3 MolecularWeight: 453.27417

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)OC)OC.[I-]

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)OC)OC.[I-]

InChI

InChI=1S/C18H19N3O3.HI/c1-20-12-21(16-7-5-4-6-15(16)20)11-18(22)19-14-10-13(23-2)8-9-17(14)24-3;/h4-10,12H,11H2,1-3H3;1H