ethyl 4-(5-chloranylpyridin-3-yl)-1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-(5-chloranylpyridin-3-yl)-1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(5-chloro-3-pyridyl)-1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-(5-chloro-3-pyridinyl)-1-ethyl-6-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-chloropyridin-3-yl)-1-ethyl-6-phenylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-(5-chloro-3-pyridyl)-1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C22H19ClN4O2 MolecularWeight: 406.86486

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=C(C(=C2C=N1)C3=CC(=CN=C3)Cl)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=NC(=C(C(=C2C=N1)C3=CC(=CN=C3)Cl)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C22H19ClN4O2/c1-3-27-21-17(13-25-27)18(15-10-16(23)12-24-11-15)19(22(28)29-4-2)20(26-21)14-8-6-5-7-9-14/h5-13H,3-4H2,1-2H3