propan-2-yl 1-(2-chloranyl-2-phenyl-ethyl)-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: propan-2-yl 1-(2-chloranyl-2-phenyl-ethyl)-4-oxidanylidene-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: isopropyl 1-(2-chloro-2-phenyl-ethyl)-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-2-phenylethyl)-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(2-chloro-2-phenylethyl)-4-oxo-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-keto-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid isopropyl ester Formula: C18H18ClN3O3 MolecularWeight: 359.80682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CN=C2C(=CNN2CC(C3=CC=CC=C3)Cl)C1=O

Isomeric SMILES

CC(C)OC(=O)C1=CN=C2C(=CNN2CC(C3=CC=CC=C3)Cl)C1=O

InChI

InChI=1S/C18H18ClN3O3/c1-11(2)25-18(24)14-8-20-17-13(16(14)23)9-21-22(17)10-15(19)12-6-4-3-5-7-12/h3-9,11,15,21H,10H2,1-2H3