2-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-3-one

Systemtic Name: 2-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-3-one Openeye Name: 2-(4-pyridyl)-5-(trifluoromethyl)-4H-pyrazol-3-one CAS Name: 2-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-3-one IUPAC Name: 2-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-3-one Traditional Name: 2-(4-pyridyl)-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C9H6F3N3O MolecularWeight: 229.15865

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=NC=C2)C(F)(F)F

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=NC=C2)C(F)(F)F

InChI

InChI=1S/C9H6F3N3O/c10-9(11,12)7-5-8(16)15(14-7)6-1-3-13-4-2-6/h1-4H,5H2