(6-chloranylpyridin-3-yl)methyl 6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-phenyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 6-phenyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (6-chloro-3-pyridyl)methyl ester Formula: C22H19ClN4O2 MolecularWeight: 406.86486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC4=CN=C(C=C4)Cl

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC4=CN=C(C=C4)Cl

InChI

InChI=1S/C22H19ClN4O2/c1-14(2)27-21-18(12-25-27)17(10-19(26-21)16-6-4-3-5-7-16)22(28)29-13-15-8-9-20(23)24-11-15/h3-12,14H,13H2,1-2H3