2-butan-2-yl-1-methyl-imidazole-4,5-dicarboxylic acid

Systemtic Name: 2-butan-2-yl-1-methyl-imidazole-4,5-dicarboxylic acid Openeye Name: 1-methyl-2-sec-butyl-imidazole-4,5-dicarboxylic acid CAS Name: 2-butan-2-yl-1-methylimidazole-4,5-dicarboxylic acid IUPAC Name: 2-butan-2-yl-1-methylimidazole-4,5-dicarboxylic acid Traditional Name: 1-methyl-2-sec-butyl-imidazole-4,5-dicarboxylic acid Formula: C10H14N2O4 MolecularWeight: 226.22916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=NC(=C(N1C)C(=O)O)C(=O)O

Isomeric SMILES

CCC(C)C1=NC(=C(N1C)C(=O)O)C(=O)O

InChI

InChI=1S/C10H14N2O4/c1-4-5(2)8-11-6(9(13)14)7(10(15)16)12(8)3/h5H,4H2,1-3H3,(H,13,14)(H,15,16)