6-methoxy-2-methyl-isoquinolin-2-ium iodide

Systemtic Name: 6-methoxy-2-methyl-isoquinolin-2-ium iodide Openeye Name: 6-methoxy-2-methyl-isoquinolin-2-ium iodide CAS Name: 6-methoxy-2-methylisoquinolin-2-ium iodide IUPAC Name: 6-methoxy-2-methylisoquinolin-2-ium iodide Traditional Name: 6-methoxy-2-methyl-isoquinolin-2-ium iodide Formula: C11H12INO MolecularWeight: 301.12355

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=C(C=C1)C=C(C=C2)OC.[I-]

Isomeric SMILES

C[N+]1=CC2=C(C=C1)C=C(C=C2)OC.[I-]

InChI

InChI=1S/C11H12NO.HI/c1-12-6-5-9-7-11(13-2)4-3-10(9)8-12;/h3-8H,1-2H3;1H/q+1;/p-1