ethyl 6-(4-fluorophenyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: ethyl 6-(4-fluorophenyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: ethyl 6-(4-fluorophenyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-(4-fluorophenyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-fluorophenyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-(4-fluorophenyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid ethyl ester Formula: C21H16FN3O2 MolecularWeight: 361.369043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=NNC(=C12)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=NNC(=C12)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O2/c1-2-27-21(26)16-12-17(13-8-10-15(22)11-9-13)23-20-18(16)19(24-25-20)14-6-4-3-5-7-14/h3-12H,2H2,1H3,(H,23,24,25)