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

Systemtic Name: (4-tert-butylphenyl)-[5-oxidanyl-3-pyridin-3-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[5-hydroxy-3-(3-pyridyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[5-hydroxy-3-(3-pyridinyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[5-hydroxy-3-pyridin-3-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[5-hydroxy-3-(3-pyridyl)-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C20H20F3N3O2 MolecularWeight: 391.38691

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(CC(=N2)C3=CN=CC=C3)(C(F)(F)F)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(CC(=N2)C3=CN=CC=C3)(C(F)(F)F)O

InChI

InChI=1S/C20H20F3N3O2/c1-18(2,3)15-8-6-13(7-9-15)17(27)26-19(28,20(21,22)23)11-16(25-26)14-5-4-10-24-12-14/h4-10,12,28H,11H2,1-3H3