4-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]benzoic acid CAS Name: 4-[[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]methyl]benzoic acid IUPAC Name: 4-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]benzoic acid Formula: C13H11F3N2O2 MolecularWeight: 284.23385

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11F3N2O2/c1-8-6-11(13(14,15)16)17-18(8)7-9-2-4-10(5-3-9)12(19)20/h2-6H,7H2,1H3,(H,19,20)