(4-cyanophenyl)methyl 3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (4-cyanophenyl)methyl 3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3,6-dimethyl-1-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3,6-dimethyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (4-cyanobenzyl) ester Formula: C23H18N4O2 MolecularWeight: 382.41462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=C1)C(=O)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=C1)C(=O)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H18N4O2/c1-15-12-20(23(28)29-14-18-10-8-17(13-24)9-11-18)21-16(2)26-27(22(21)25-15)19-6-4-3-5-7-19/h3-12H,14H2,1-2H3