2-[(3-methoxyphenyl)-[(4-methoxyphenyl)methoxy]methyl]-1,3-dimethyl-imidazol-1-ium iodide

Systemtic Name: 2-[(3-methoxyphenyl)-[(4-methoxyphenyl)methoxy]methyl]-1,3-dimethyl-imidazol-1-ium iodide Openeye Name: 2-[(3-methoxyphenyl)-[(4-methoxyphenyl)methoxy]methyl]-1,3-dimethyl-imidazol-1-ium iodide CAS Name: 2-[(3-methoxyphenyl)-[(4-methoxyphenyl)methoxy]methyl]-1,3-dimethylimidazol-1-ium iodide IUPAC Name: 2-[(3-methoxyphenyl)-[(4-methoxyphenyl)methoxy]methyl]-1,3-dimethylimidazol-1-ium iodide Traditional Name: 2-[(3-methoxyphenyl)-p-anisyloxy-methyl]-1,3-dimethyl-imidazol-1-ium iodide Formula: C21H25IN2O3 MolecularWeight: 480.33927

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C[N+](=C1C(C2=CC(=CC=C2)OC)OCC3=CC=C(C=C3)OC)C.[I-]

Isomeric SMILES

CN1C=C[N+](=C1C(C2=CC(=CC=C2)OC)OCC3=CC=C(C=C3)OC)C.[I-]

InChI

InChI=1S/C21H25N2O3.HI/c1-22-12-13-23(2)21(22)20(17-6-5-7-19(14-17)25-4)26-15-16-8-10-18(24-3)11-9-16;/h5-14,20H,15H2,1-4H3;1H/q+1;/p-1