2-[3-cyano-4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]-5-oxidanyl-pyridine-4-carboxylic acid

Systemtic Name: 2-[3-cyano-4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]-5-oxidanyl-pyridine-4-carboxylic acid Openeye Name: 2-[3-cyano-4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]-5-hydroxy-pyridine-4-carboxylic acid CAS Name: 2-[3-cyano-4-[3-(trifluoromethyl)-1-pyrazolyl]phenyl]-5-hydroxy-4-pyridinecarboxylic acid IUPAC Name: 2-[3-cyano-4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]-5-hydroxypyridine-4-carboxylic acid Traditional Name: 2-[3-cyano-4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]-5-hydroxy-isonicotinic acid Formula: C17H9F3N4O3 MolecularWeight: 374.27357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NC=C(C(=C2)C(=O)O)O)C#N)N3C=CC(=N3)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C2=NC=C(C(=C2)C(=O)O)O)C#N)N3C=CC(=N3)C(F)(F)F

InChI

InChI=1S/C17H9F3N4O3/c18-17(19,20)15-3-4-24(23-15)13-2-1-9(5-10(13)7-21)12-6-11(16(26)27)14(25)8-22-12/h1-6,8,25H,(H,26,27)