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

Systemtic Name: 3-cyano-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-cyano-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-cyano-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-cyano-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3-cyano-1-phenyl-pyrazole-4-carboxylic acid Formula: C11H7N3O2 MolecularWeight: 213.19218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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