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

Systemtic Name: 2-[3-cyclopropyl-6-ethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanoic acid Openeye Name: 2-[3-cyclopropyl-6-ethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetic acid CAS Name: 2-[3-cyclopropyl-6-ethyl-4-(trifluoromethyl)-1-pyrazolo[3,4-b]pyridinyl]acetic acid IUPAC Name: 2-[3-cyclopropyl-6-ethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetic acid Traditional Name: 2-[3-cyclopropyl-6-ethyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetic acid Formula: C14H14F3N3O2 MolecularWeight: 313.27507

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C1)C(F)(F)F)C(=NN2CC(=O)O)C3CC3

Isomeric SMILES

CCC1=NC2=C(C(=C1)C(F)(F)F)C(=NN2CC(=O)O)C3CC3

InChI

InChI=1S/C14H14F3N3O2/c1-2-8-5-9(14(15,16)17)11-12(7-3-4-7)19-20(6-10(21)22)13(11)18-8/h5,7H,2-4,6H2,1H3,(H,21,22)