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

Systemtic Name: (4-tert-butylphenyl)-[3-(4-methoxyphenyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C22H23F3N2O3 MolecularWeight: 420.42483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23F3N2O3/c1-20(2,3)16-9-5-15(6-10-16)19(28)27-21(29,22(23,24)25)13-18(26-27)14-7-11-17(30-4)12-8-14/h5-12,29H,13H2,1-4H3