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

Systemtic Name: propan-2-yl 1-(2-chloranyl-2-phenyl-ethyl)-4-morpholin-4-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: isopropyl 1-(2-chloro-2-phenyl-ethyl)-4-morpholino-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-2-phenylethyl)-4-(4-morpholinyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(2-chloro-2-phenylethyl)-4-morpholin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-morpholino-pyrazolo[3,4-b]pyridine-5-carboxylic acid isopropyl ester Formula: C22H25ClN4O3 MolecularWeight: 428.9119

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CN=C2C(=C1N3CCOCC3)C=NN2CC(C4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)OC(=O)C1=CN=C2C(=C1N3CCOCC3)C=NN2CC(C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H25ClN4O3/c1-15(2)30-22(28)18-12-24-21-17(20(18)26-8-10-29-11-9-26)13-25-27(21)14-19(23)16-6-4-3-5-7-16/h3-7,12-13,15,19H,8-11,14H2,1-2H3