3-cyano-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-cyano-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-cyano-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-cyano-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-cyano-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-cyano-1-methyl-pyrazole-4-carboxylic acid Formula: C6H5N3O2 MolecularWeight: 151.1228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C#N)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C#N)C(=O)O

InChI

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