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

Systemtic Name: 2-[3-methyl-6-naphthalen-2-yl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanoate Openeye Name: 2-[3-methyl-6-(2-naphthyl)-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetate CAS Name: 2-[3-methyl-6-(2-naphthalenyl)-4-(trifluoromethyl)-1-pyrazolo[3,4-b]pyridinyl]acetate IUPAC Name: 2-[3-methyl-6-naphthalen-2-yl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetate Traditional Name: 2-[3-methyl-6-(2-naphthyl)-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]acetate Formula: C20H13F3N3O2- MolecularWeight: 384.33133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC4=CC=CC=C4C=C3)C(F)(F)F)CC(=O)[O-]

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC4=CC=CC=C4C=C3)C(F)(F)F)CC(=O)[O-]

InChI

InChI=1S/C20H14F3N3O2/c1-11-18-15(20(21,22)23)9-16(24-19(18)26(25-11)10-17(27)28)14-7-6-12-4-2-3-5-13(12)8-14/h2-9H,10H2,1H3,(H,27,28)/p-1