[3-tert-butyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [3-tert-butyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-3-yl-methanone Openeye Name: [3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(3-pyridyl)methanone CAS Name: [3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(3-pyridinyl)methanone IUPAC Name: [3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-3-ylmethanone Traditional Name: [3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-(3-pyridyl)methanone Formula: C14H16F3N3O2 MolecularWeight: 315.29095

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)C1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H16F3N3O2/c1-12(2,3)10-7-13(22,14(15,16)17)20(19-10)11(21)9-5-4-6-18-8-9/h4-6,8,22H,7H2,1-3H3