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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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