2-(3-methylimidazol-3-ium-1-yl)ethyl 3-oxidanylidenebutanoate

Systemtic Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl 3-oxidanylidenebutanoate Openeye Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 2-(3-methyl-1-imidazol-3-iumyl)ethyl ester IUPAC Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 2-(3-methylimidazol-3-ium-1-yl)ethyl ester Formula: C10H15N2O3+ MolecularWeight: 211.2377

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCN1C=C[N+](=C1)C

Isomeric SMILES

CC(=O)CC(=O)OCCN1C=C[N+](=C1)C

InChI

InChI=1S/C10H15N2O3/c1-9(13)7-10(14)15-6-5-12-4-3-11(2)8-12/h3-4,8H,5-7H2,1-2H3/q+1