3-(1-ethoxy-1-oxidanylidene-propan-2-yl)-5-methyl-imidazole-4-carboxylic acid

Systemtic Name: 3-(1-ethoxy-1-oxidanylidene-propan-2-yl)-5-methyl-imidazole-4-carboxylic acid Openeye Name: 3-(2-ethoxy-1-methyl-2-oxo-ethyl)-5-methyl-imidazole-4-carboxylic acid CAS Name: 3-(1-ethoxy-1-oxopropan-2-yl)-5-methyl-4-imidazolecarboxylic acid IUPAC Name: 3-(1-ethoxy-1-oxopropan-2-yl)-5-methylimidazole-4-carboxylic acid Traditional Name: 3-(2-ethoxy-2-keto-1-methyl-ethyl)-5-methyl-imidazole-4-carboxylic acid Formula: C10H14N2O4 MolecularWeight: 226.22916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1C=NC(=C1C(=O)O)C

Isomeric SMILES

CCOC(=O)C(C)N1C=NC(=C1C(=O)O)C

InChI

InChI=1S/C10H14N2O4/c1-4-16-10(15)7(3)12-5-11-6(2)8(12)9(13)14/h5,7H,4H2,1-3H3,(H,13,14)