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

Systemtic Name: (4-cyanophenyl)methyl 1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (4-cyanophenyl)methyl 1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-ethyl-3,6-dimethyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 1-ethyl-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (4-cyanobenzyl) ester Formula: C19H18N4O2 MolecularWeight: 334.37182

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=N1)C)C(=CC(=N2)C)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCN1C2=C(C(=N1)C)C(=CC(=N2)C)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H18N4O2/c1-4-23-18-17(13(3)22-23)16(9-12(2)21-18)19(24)25-11-15-7-5-14(10-20)6-8-15/h5-9H,4,11H2,1-3H3