1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-ethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-5-ethyl-pyrazole-4-carboxylic acid Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-5-ethyl-pyrazole-4-carboxylic acid CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-ethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-ethylpyrazole-4-carboxylic acid Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-5-ethyl-pyrazole-4-carboxylic acid Formula: C12H9ClF3N3O2 MolecularWeight: 319.66697

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)O

Isomeric SMILES

CCC1=C(C=NN1C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)O

InChI

InChI=1S/C12H9ClF3N3O2/c1-2-9-7(11(20)21)5-18-19(9)10-8(13)3-6(4-17-10)12(14,15)16/h3-5H,2H2,1H3,(H,20,21)