tert-butyl 2-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-2-oxidanylidene-ethanoate

Systemtic Name: tert-butyl 2-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-2-oxidanylidene-ethanoate Openeye Name: tert-butyl 2-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-2-oxo-acetate CAS Name: 2-[methyl-(3-methyl-1-imidazol-3-iumyl)amino]-2-oxoacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[methyl-(3-methylimidazol-3-ium-1-yl)amino]-2-oxoacetate Traditional Name: 2-keto-2-[methyl-(3-methylimidazol-3-ium-1-yl)amino]acetic acid tert-butyl ester Formula: C11H18N3O3+ MolecularWeight: 240.27892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=O)N(C)N1C=C[N+](=C1)C

Isomeric SMILES

CC(C)(C)OC(=O)C(=O)N(C)N1C=C[N+](=C1)C

InChI

InChI=1S/C11H18N3O3/c1-11(2,3)17-10(16)9(15)13(5)14-7-6-12(4)8-14/h6-8H,1-5H3/q+1