1-methyl-3-[4-(trifluoromethyloxy)phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-3-[4-(trifluoromethyloxy)phenyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-3-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-3-[4-(trifluoromethoxy)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-3-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-3-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxylic acid Formula: C12H9F3N2O3 MolecularWeight: 286.20667

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)OC(F)(F)F)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)OC(F)(F)F)C(=O)O

InChI

InChI=1S/C12H9F3N2O3/c1-17-6-9(11(18)19)10(16-17)7-2-4-8(5-3-7)20-12(13,14)15/h2-6H,1H3,(H,18,19)