[4-(4-cyanophenyl)phenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C22H16N4O2 MolecularWeight: 368.38804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)C

InChI

InChI=1S/C22H16N4O2/c1-14-20-11-18(13-24-21(20)26(2)25-14)22(27)28-19-9-7-17(8-10-19)16-5-3-15(12-23)4-6-16/h3-11,13H,1-2H3