tert-butyl 1-methylpyridin-1-ium-3-carboxylate iodide

Systemtic Name: tert-butyl 1-methylpyridin-1-ium-3-carboxylate iodide Openeye Name: tert-butyl 1-methylpyridin-1-ium-3-carboxylate iodide CAS Name: 1-methyl-3-pyridin-1-iumcarboxylic acid tert-butyl ester iodide IUPAC Name: tert-butyl 1-methylpyridin-1-ium-3-carboxylate iodide Traditional Name: 1-methylpyridin-1-ium-3-carboxylic acid tert-butyl ester iodide Formula: C11H16INO2 MolecularWeight: 321.15471

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C[N+](=CC=C1)C.[I-]

Isomeric SMILES

CC(C)(C)OC(=O)C1=C[N+](=CC=C1)C.[I-]

InChI

InChI=1S/C11H16NO2.HI/c1-11(2,3)14-10(13)9-6-5-7-12(4)8-9;/h5-8H,1-4H3;1H/q+1;/p-1