cyclohexyl 2-[(1-methylpyridin-1-ium-3-yl)carbonylamino]butanoate iodide

Systemtic Name: cyclohexyl 2-[(1-methylpyridin-1-ium-3-yl)carbonylamino]butanoate iodide Openeye Name: cyclohexyl 2-[(1-methylpyridin-1-ium-3-carbonyl)amino]butanoate iodide CAS Name: 2-[[(1-methyl-3-pyridin-1-iumyl)-oxomethyl]amino]butanoic acid cyclohexyl ester iodide IUPAC Name: cyclohexyl 2-[(1-methylpyridin-1-ium-3-carbonyl)amino]butanoate iodide Traditional Name: 2-[(1-methylpyridin-1-ium-3-carbonyl)amino]butyric acid cyclohexyl ester iodide Formula: C17H25IN2O3 MolecularWeight: 432.29647

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1CCCCC1)NC(=O)C2=C[N+](=CC=C2)C.[I-]

Isomeric SMILES

CCC(C(=O)OC1CCCCC1)NC(=O)C2=C[N+](=CC=C2)C.[I-]

InChI

InChI=1S/C17H24N2O3.HI/c1-3-15(17(21)22-14-9-5-4-6-10-14)18-16(20)13-8-7-11-19(2)12-13;/h7-8,11-12,14-15H,3-6,9-10H2,1-2H3;1H