ethyl 3-methyl-4-oxidanylidene-1-(phenylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 3-methyl-4-oxidanylidene-1-(phenylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1-benzyl-3-methyl-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 3-methyl-4-oxo-1-(phenylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3-methyl-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-benzyl-4-keto-3-methyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C(NN2CC3=CC=CC=C3)C)C1=O

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C(NN2CC3=CC=CC=C3)C)C1=O

InChI

InChI=1S/C17H17N3O3/c1-3-23-17(22)13-9-18-16-14(15(13)21)11(2)19-20(16)10-12-7-5-4-6-8-12/h4-9,19H,3,10H2,1-2H3