5-cyano-4,5-dihydro-1H-pyrazole-3,4-dicarboxylic acid

Systemtic Name: 5-cyano-4,5-dihydro-1H-pyrazole-3,4-dicarboxylic acid Openeye Name: 5-cyano-4,5-dihydro-1H-pyrazole-3,4-dicarboxylic acid CAS Name: 5-cyano-4,5-dihydro-1H-pyrazole-3,4-dicarboxylic acid IUPAC Name: 5-cyano-4,5-dihydro-1H-pyrazole-3,4-dicarboxylic acid Traditional Name: 5-cyano-2-pyrazoline-3,4-dicarboxylic acid Formula: C6H5N3O4 MolecularWeight: 183.1216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(#N)C1C(C(=NN1)C(=O)O)C(=O)O

Isomeric SMILES

C(#N)C1C(C(=NN1)C(=O)O)C(=O)O

InChI

InChI=1S/C6H5N3O4/c7-1-2-3(5(10)11)4(6(12)13)9-8-2/h2-3,8H,(H,10,11)(H,12,13)