5-(cyanomethyl)-2-methyl-1H-imidazole-4-carboxylic acid

Systemtic Name: 5-(cyanomethyl)-2-methyl-1H-imidazole-4-carboxylic acid Openeye Name: 5-(cyanomethyl)-2-methyl-1H-imidazole-4-carboxylic acid CAS Name: 5-(cyanomethyl)-2-methyl-1H-imidazole-4-carboxylic acid IUPAC Name: 5-(cyanomethyl)-2-methyl-1H-imidazole-4-carboxylic acid Traditional Name: 5-(cyanomethyl)-2-methyl-1H-imidazole-4-carboxylic acid Formula: C7H7N3O2 MolecularWeight: 165.14938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1)CC#N)C(=O)O

Isomeric SMILES

CC1=NC(=C(N1)CC#N)C(=O)O

InChI

InChI=1S/C7H7N3O2/c1-4-9-5(2-3-8)6(10-4)7(11)12/h2H2,1H3,(H,9,10)(H,11,12)