1-(4-methoxyphenyl)-5-propan-2-yl-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-methoxyphenyl)-5-propan-2-yl-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Openeye Name: 5-isopropyl-1-(4-methoxyphenyl)-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid CAS Name: 1-(4-methoxyphenyl)-5-propan-2-yl-3-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-methoxyphenyl)-5-propan-2-yl-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Traditional Name: 5-isopropyl-1-(4-methoxyphenyl)-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Formula: C21H19F3N2O3 MolecularWeight: 404.38237

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C21H19F3N2O3/c1-12(2)19-17(20(27)28)18(13-4-6-14(7-5-13)21(22,23)24)25-26(19)15-8-10-16(29-3)11-9-15/h4-12H,1-3H3,(H,27,28)