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

Systemtic Name: ethyl 4-chloranyl-3-methyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1-benzyl-4-chloro-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-chloro-3-methyl-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-chloro-3-methylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-benzyl-4-chloro-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C17H16ClN3O2 MolecularWeight: 329.78084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1Cl)C(=NN2CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1Cl)C(=NN2CC3=CC=CC=C3)C

InChI

InChI=1S/C17H16ClN3O2/c1-3-23-17(22)13-9-19-16-14(15(13)18)11(2)20-21(16)10-12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3