1-(2-cyanoethyl)-6-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: 1-(2-cyanoethyl)-6-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-(2-cyanoethyl)-6-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(2-cyanoethyl)-6-(4-fluorophenyl)-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-(2-cyanoethyl)-6-(4-fluorophenyl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(2-cyanoethyl)-6-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C17H12FN4O2- MolecularWeight: 323.301183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)[O-])CCC#N

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)[O-])CCC#N

InChI

InChI=1S/C17H13FN4O2/c1-10-15-13(17(23)24)9-14(11-3-5-12(18)6-4-11)20-16(15)22(21-10)8-2-7-19/h3-6,9H,2,8H2,1H3,(H,23,24)/p-1