5-cyano-1-methyl-imidazole-4-carboxylic acid

Systemtic Name: 5-cyano-1-methyl-imidazole-4-carboxylic acid Openeye Name: 5-cyano-1-methyl-imidazole-4-carboxylic acid CAS Name: 5-cyano-1-methyl-4-imidazolecarboxylic acid IUPAC Name: 5-cyano-1-methylimidazole-4-carboxylic acid Traditional Name: 5-cyano-1-methyl-imidazole-4-carboxylic acid Formula: C6H5N3O2 MolecularWeight: 151.1228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1C#N)C(=O)O

Isomeric SMILES

CN1C=NC(=C1C#N)C(=O)O

InChI

InChI=1S/C6H5N3O2/c1-9-3-8-5(6(10)11)4(9)2-7/h3H,1H3,(H,10,11)