methyl 1-methylquinolin-1-ium-6-carboxylate iodide

Systemtic Name: methyl 1-methylquinolin-1-ium-6-carboxylate iodide Openeye Name: methyl 1-methylquinolin-1-ium-6-carboxylate iodide CAS Name: 1-methyl-6-quinolin-1-iumcarboxylic acid methyl ester iodide IUPAC Name: methyl 1-methylquinolin-1-ium-6-carboxylate iodide Traditional Name: 1-methylquinolin-1-ium-6-carboxylic acid methyl ester iodide Formula: C12H12INO2 MolecularWeight: 329.13365

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC2=C1C=CC(=C2)C(=O)OC.[I-]

Isomeric SMILES

C[N+]1=CC=CC2=C1C=CC(=C2)C(=O)OC.[I-]

InChI

InChI=1S/C12H12NO2.HI/c1-13-7-3-4-9-8-10(12(14)15-2)5-6-11(9)13;/h3-8H,1-2H3;1H/q+1;/p-1