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

Systemtic Name: methyl 1-(2-chloranyl-2-phenyl-ethyl)-4-morpholin-4-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C20H21ClN4O3 MolecularWeight: 400.85874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O3/c1-27-20(26)16-11-22-19-15(18(16)24-7-9-28-10-8-24)12-23-25(19)13-17(21)14-5-3-2-4-6-14/h2-6,11-12,17H,7-10,13H2,1H3