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

Systemtic Name: [5-tert-butyl-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-dimethylaminophenyl)methanone Openeye Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-dimethylaminophenyl)methanone CAS Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-dimethylaminophenyl)methanone IUPAC Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-dimethylaminophenyl)methanone Traditional Name: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(4-dimethylaminophenyl)methanone Formula: C17H22F3N3O2 MolecularWeight: 357.37069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CC(=NN1C(=O)C2=CC=C(C=C2)N(C)C)C(F)(F)F)O

Isomeric SMILES

CC(C)(C)C1(CC(=NN1C(=O)C2=CC=C(C=C2)N(C)C)C(F)(F)F)O

InChI

InChI=1S/C17H22F3N3O2/c1-15(2,3)16(25)10-13(17(18,19)20)21-23(16)14(24)11-6-8-12(9-7-11)22(4)5/h6-9,25H,10H2,1-5H3