5-(4-cyanophenyl)-1H-pyrazole-4-carboxylate

Systemtic Name: 5-(4-cyanophenyl)-1H-pyrazole-4-carboxylate Openeye Name: 5-(4-cyanophenyl)-1H-pyrazole-4-carboxylate CAS Name: 5-(4-cyanophenyl)-1H-pyrazole-4-carboxylate IUPAC Name: 5-(4-cyanophenyl)-1H-pyrazole-4-carboxylate Traditional Name: 5-(4-cyanophenyl)-1H-pyrazole-4-carboxylate Formula: C11H6N3O2- MolecularWeight: 212.18424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=C(C=NN2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=C(C=NN2)C(=O)[O-]

InChI

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