5-cyano-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-cyano-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-cyano-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-cyano-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-cyano-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-cyano-1-phenyl-pyrazole-4-carboxylic acid Formula: C11H7N3O2 MolecularWeight: 213.19218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)C#N

InChI

InChI=1S/C11H7N3O2/c12-6-10-9(11(15)16)7-13-14(10)8-4-2-1-3-5-8/h1-5,7H,(H,15,16)