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

Systemtic Name: 2-[(3-methoxyphenyl)-[(4-methylphenyl)methoxy]methyl]-1,3-dimethyl-imidazol-1-ium iodide Openeye Name: 2-[(3-methoxyphenyl)-(p-tolylmethoxy)methyl]-1,3-dimethyl-imidazol-1-ium iodide CAS Name: 2-[(3-methoxyphenyl)-[(4-methylphenyl)methoxy]methyl]-1,3-dimethylimidazol-1-ium iodide IUPAC Name: 2-[(3-methoxyphenyl)-[(4-methylphenyl)methoxy]methyl]-1,3-dimethylimidazol-1-ium iodide Traditional Name: 2-[(3-methoxyphenyl)-(4-methylbenzyl)oxy-methyl]-1,3-dimethyl-imidazol-1-ium iodide Formula: C21H25IN2O2 MolecularWeight: 464.33987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(C2=CC(=CC=C2)OC)C3=[N+](C=CN3C)C.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)COC(C2=CC(=CC=C2)OC)C3=[N+](C=CN3C)C.[I-]

InChI

InChI=1S/C21H25N2O2.HI/c1-16-8-10-17(11-9-16)15-25-20(21-22(2)12-13-23(21)3)18-6-5-7-19(14-18)24-4;/h5-14,20H,15H2,1-4H3;1H/q+1;/p-1