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

Systemtic Name: ethyl 4-chloranyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1-benzyl-4-chloro-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-chloro-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-chloropyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-benzyl-4-chloro-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O2/c1-2-22-16(21)13-8-18-15-12(14(13)17)9-19-20(15)10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3