ethyl 1-(3-methylimidazol-3-ium-1-yl)carbonylpiperidine-4-carboxylate iodide

Systemtic Name: ethyl 1-(3-methylimidazol-3-ium-1-yl)carbonylpiperidine-4-carboxylate iodide Openeye Name: ethyl 1-(3-methylimidazol-3-ium-1-carbonyl)piperidine-4-carboxylate iodide CAS Name: 1-[(3-methyl-1-imidazol-3-iumyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester iodide IUPAC Name: ethyl 1-(3-methylimidazol-3-ium-1-carbonyl)piperidine-4-carboxylate iodide Traditional Name: 1-(3-methylimidazol-3-ium-1-carbonyl)isonipecotic acid ethyl ester iodide Formula: C13H20IN3O3 MolecularWeight: 393.22067

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)N2C=C[N+](=C2)C.[I-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)N2C=C[N+](=C2)C.[I-]

InChI

InChI=1S/C13H20N3O3.HI/c1-3-19-12(17)11-4-6-15(7-5-11)13(18)16-9-8-14(2)10-16;/h8-11H,3-7H2,1-2H3;1H/q+1;/p-1