(3-acetamidophenyl) 1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (3-acetamidophenyl) 1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (3-acetamidophenyl) 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid (3-acetamidophenyl) ester IUPAC Name: (3-acetamidophenyl) 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylic acid (3-acetamidophenyl) ester Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)OC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)OC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3/c1-15(27)25-19-8-5-9-20(11-19)29-22(28)18-10-17-13-24-26(21(17)23-12-18)14-16-6-3-2-4-7-16/h2-13H,14H2,1H3,(H,25,27)