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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

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