5-(5-cyanopyridin-2-yl)-1-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 5-(5-cyanopyridin-2-yl)-1-phenyl-pyrazole-3-carboxylic acid Openeye Name: 5-(5-cyano-2-pyridyl)-1-phenyl-pyrazole-3-carboxylic acid CAS Name: 5-(5-cyano-2-pyridinyl)-1-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 5-(5-cyanopyridin-2-yl)-1-phenylpyrazole-3-carboxylic acid Traditional Name: 5-(5-cyano-2-pyridyl)-1-phenyl-pyrazole-3-carboxylic acid Formula: C16H10N4O2 MolecularWeight: 290.2762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=NC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C16H10N4O2/c17-9-11-6-7-13(18-10-11)15-8-14(16(21)22)19-20(15)12-4-2-1-3-5-12/h1-8,10H,(H,21,22)