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

Systemtic Name: [5-tert-butyl-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methylphenyl)methanone Openeye Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(p-tolyl)methanone CAS Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methylphenyl)methanone IUPAC Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methylphenyl)methanone Traditional Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(p-tolyl)methanone Formula: C16H19F3N2O2 MolecularWeight: 328.32947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(CC(=N2)C(F)(F)F)(C(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(CC(=N2)C(F)(F)F)(C(C)(C)C)O

InChI

InChI=1S/C16H19F3N2O2/c1-10-5-7-11(8-6-10)13(22)21-15(23,14(2,3)4)9-12(20-21)16(17,18)19/h5-8,23H,9H2,1-4H3