1-(4-methoxyphenyl)-2-(3-methylisoquinolin-2-ium-2-yl)ethanone iodide

Systemtic Name: 1-(4-methoxyphenyl)-2-(3-methylisoquinolin-2-ium-2-yl)ethanone iodide Openeye Name: 1-(4-methoxyphenyl)-2-(3-methylisoquinolin-2-ium-2-yl)ethanone iodide CAS Name: 1-(4-methoxyphenyl)-2-(3-methyl-2-isoquinolin-2-iumyl)ethanone iodide IUPAC Name: 1-(4-methoxyphenyl)-2-(3-methylisoquinolin-2-ium-2-yl)ethanone iodide Traditional Name: 1-(4-methoxyphenyl)-2-(3-methylisoquinolin-2-ium-2-yl)ethanone iodide Formula: C19H18INO2 MolecularWeight: 419.25619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C=[N+]1CC(=O)C3=CC=C(C=C3)OC.[I-]

Isomeric SMILES

CC1=CC2=CC=CC=C2C=[N+]1CC(=O)C3=CC=C(C=C3)OC.[I-]

InChI

InChI=1S/C19H18NO2.HI/c1-14-11-16-5-3-4-6-17(16)12-20(14)13-19(21)15-7-9-18(22-2)10-8-15;/h3-12H,13H2,1-2H3;1H/q+1;/p-1