[3-(trifluoromethyl)phenyl]methyl 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid [3-(trifluoromethyl)benzyl] ester Formula: C18H16F3N3O2 MolecularWeight: 363.33375

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H16F3N3O2/c1-11(2)24-16-13(9-23-24)7-14(8-22-16)17(25)26-10-12-4-3-5-15(6-12)18(19,20)21/h3-9,11H,10H2,1-2H3