methyl 4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-4-oxidanylidene-butanoate iodide

Systemtic Name: methyl 4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-4-oxidanylidene-butanoate iodide Openeye Name: methyl 4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-4-oxo-butanoate iodide CAS Name: 4-[methyl-(3-methyl-1-imidazol-3-iumyl)amino]-4-oxobutanoic acid methyl ester iodide IUPAC Name: methyl 4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-4-oxobutanoate iodide Traditional Name: 4-keto-4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]butyric acid methyl ester iodide Formula: C10H16IN3O3 MolecularWeight: 353.15681

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)N(C)C(=O)CCC(=O)OC.[I-]

Isomeric SMILES

C[N+]1=CN(C=C1)N(C)C(=O)CCC(=O)OC.[I-]

InChI

InChI=1S/C10H16N3O3.HI/c1-11-6-7-13(8-11)12(2)9(14)4-5-10(15)16-3;/h6-8H,4-5H2,1-3H3;1H/q+1;/p-1