(2-chloranyl-4-cyano-phenyl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (2-chloro-4-cyano-phenyl) 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid (2-chloro-4-cyano-phenyl) ester Formula: C17H13ClN4O2 MolecularWeight: 340.76372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C17H13ClN4O2/c1-10(2)22-16-12(9-21-22)6-13(8-20-16)17(23)24-15-4-3-11(7-19)5-14(15)18/h3-6,8-10H,1-2H3