ethyl 1-(2-cyanoethyl)-6-(2-fluoranyl-4-methoxy-phenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: ethyl 1-(2-cyanoethyl)-6-(2-fluoranyl-4-methoxy-phenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: ethyl 1-(2-cyanoethyl)-6-(2-fluoro-4-methoxy-phenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(2-cyanoethyl)-6-(2-fluoro-4-methoxyphenyl)-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-cyanoethyl)-6-(2-fluoro-4-methoxyphenyl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(2-cyanoethyl)-6-(2-fluoro-4-methoxy-phenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid ethyl ester Formula: C20H19FN4O3 MolecularWeight: 382.388263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=C1C(=NN2CCC#N)C)C3=C(C=C(C=C3)OC)F

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=C1C(=NN2CCC#N)C)C3=C(C=C(C=C3)OC)F

InChI

InChI=1S/C20H19FN4O3/c1-4-28-20(26)15-11-17(14-7-6-13(27-3)10-16(14)21)23-19-18(15)12(2)24-25(19)9-5-8-22/h6-7,10-11H,4-5,9H2,1-3H3