2-[6-cyclopropyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanoate

Systemtic Name: 2-[6-cyclopropyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanoate Openeye Name: 2-[6-cyclopropyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetate CAS Name: 2-[6-cyclopropyl-3-methyl-4-(trifluoromethyl)-1-pyrazolo[3,4-b]pyridinyl]acetate IUPAC Name: 2-[6-cyclopropyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetate Traditional Name: 2-[6-cyclopropyl-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetate Formula: C13H11F3N3O2- MolecularWeight: 298.24055

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(F)(F)F)CC(=O)[O-]

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(F)(F)F)CC(=O)[O-]

InChI

InChI=1S/C13H12F3N3O2/c1-6-11-8(13(14,15)16)4-9(7-2-3-7)17-12(11)19(18-6)5-10(20)21/h4,7H,2-3,5H2,1H3,(H,20,21)/p-1