[1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [2-(4-fluorophenyl)-1-methyl-2-oxo-ethyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [1-(4-fluorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-fluorophenyl)-1-oxopropan-2-yl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid [2-(4-fluorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C18H16FN3O3 MolecularWeight: 341.336343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)OC(C)C(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)OC(C)C(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C18H16FN3O3/c1-10-15-8-13(9-20-17(15)22(3)21-10)18(24)25-11(2)16(23)12-4-6-14(19)7-5-12/h4-9,11H,1-3H3