1-(3,5-dimethylphenyl)-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: 1-(3,5-dimethylphenyl)-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: 1-(3,5-dimethylphenyl)-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(3,5-dimethylphenyl)-3-methyl-4-(trifluoromethyl)-5-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-(3,5-dimethylphenyl)-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(3,5-dimethylphenyl)-3-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine-5-carboxylate Formula: C17H13F3N3O2- MolecularWeight: 348.29923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C3=NC=C(C(=C3C(=N2)C)C(F)(F)F)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C3=NC=C(C(=C3C(=N2)C)C(F)(F)F)C(=O)[O-])C

InChI

InChI=1S/C17H14F3N3O2/c1-8-4-9(2)6-11(5-8)23-15-13(10(3)22-23)14(17(18,19)20)12(7-21-15)16(24)25/h4-7H,1-3H3,(H,24,25)/p-1