2-[6-ethyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanoic acid

Systemtic Name: 2-[6-ethyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanoic acid Openeye Name: 2-[6-ethyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetic acid CAS Name: 2-[6-ethyl-3-methyl-4-(trifluoromethyl)-1-pyrazolo[3,4-b]pyridinyl]acetic acid IUPAC Name: 2-[6-ethyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetic acid Traditional Name: 2-[6-ethyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetic acid Formula: C12H12F3N3O2 MolecularWeight: 287.23779

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=NN2CC(=O)O)C)C(=C1)C(F)(F)F

Isomeric SMILES

CCC1=NC2=C(C(=NN2CC(=O)O)C)C(=C1)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O2/c1-3-7-4-8(12(13,14)15)10-6(2)17-18(5-9(19)20)11(10)16-7/h4H,3,5H2,1-2H3,(H,19,20)