3-[2-methyl-6-oxidanylidene-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoic acid

Systemtic Name: 3-[2-methyl-6-oxidanylidene-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoic acid Openeye Name: 3-[2-methyl-6-oxo-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoic acid CAS Name: 3-[2-methyl-6-oxo-4-(trifluoromethyl)-7-pyrazolo[3,4-b]pyridinyl]propanoic acid IUPAC Name: 3-[2-methyl-6-oxo-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propanoic acid Traditional Name: 3-[6-keto-2-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-7-yl]propionic acid Formula: C11H10F3N3O3 MolecularWeight: 289.21061

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C2C(=CC(=O)N(C2=N1)CCC(=O)O)C(F)(F)F

Isomeric SMILES

CN1C=C2C(=CC(=O)N(C2=N1)CCC(=O)O)C(F)(F)F

InChI

InChI=1S/C11H10F3N3O3/c1-16-5-6-7(11(12,13)14)4-8(18)17(10(6)15-16)3-2-9(19)20/h4-5H,2-3H2,1H3,(H,19,20)