ethyl 4-phenyl-6-(trifluoromethyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-phenyl-6-(trifluoromethyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-phenyl-6-(trifluoromethyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-phenyl-6-(trifluoromethyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-6-(trifluoromethyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-phenyl-6-(trifluoromethyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C16H14F3N3O2 MolecularWeight: 337.29647

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H14F3N3O2/c1-2-24-15(23)12-11(9-6-4-3-5-7-9)10-8-20-22-14(10)21-13(12)16(17,18)19/h3-8,11H,2H2,1H3,(H2,20,21,22)