3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Traditional Name: 3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Formula: C13H11F3N2O2 MolecularWeight: 284.23385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(F)(F)F)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(F)(F)F)C)C(=O)O

InChI

InChI=1S/C13H11F3N2O2/c1-7-11(12(19)20)8(2)18(17-7)10-5-3-9(4-6-10)13(14,15)16/h3-6H,1-2H3,(H,19,20)