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

Systemtic Name: methyl 4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-4-oxo-butanoate CAS Name: 4-[methyl-(3-methyl-1-imidazol-3-iumyl)amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[methyl-(3-methylimidazol-3-ium-1-yl)amino]butyric acid methyl ester Formula: C10H16N3O3+ MolecularWeight: 226.25234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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