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

Systemtic Name: ethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-morpholin-4-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C21H23ClN4O3 MolecularWeight: 414.88532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN4O3/c1-2-29-21(27)17-12-23-20-16(19(17)25-8-10-28-11-9-25)13-24-26(20)14-18(22)15-6-4-3-5-7-15/h3-7,12-13,18H,2,8-11,14H2,1H3