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

Systemtic Name: 3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-4-carboxylic acid Traditional Name: 3,5-dimethyl-1-[3-(trifluoromethyl)benzyl]pyrazole-4-carboxylic acid Formula: C14H13F3N2O2 MolecularWeight: 298.26043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)C(F)(F)F)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)C(F)(F)F)C)C(=O)O

InChI

InChI=1S/C14H13F3N2O2/c1-8-12(13(20)21)9(2)19(18-8)7-10-4-3-5-11(6-10)14(15,16)17/h3-6H,7H2,1-2H3,(H,20,21)