methyl 1-methylquinolin-1-ium-2-carboxylate iodide

Systemtic Name: methyl 1-methylquinolin-1-ium-2-carboxylate iodide Openeye Name: methyl 1-methylquinolin-1-ium-2-carboxylate iodide CAS Name: 1-methyl-2-quinolin-1-iumcarboxylic acid methyl ester iodide IUPAC Name: methyl 1-methylquinolin-1-ium-2-carboxylate iodide Traditional Name: 1-methylquinolin-1-ium-2-carboxylic acid methyl ester iodide Formula: C12H12INO2 MolecularWeight: 329.13365

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC2=CC=CC=C21)C(=O)OC.[I-]

Isomeric SMILES

C[N+]1=C(C=CC2=CC=CC=C21)C(=O)OC.[I-]

InChI

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