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

Systemtic Name: ethyl 1-(2-chloranyl-3-phenoxy-propyl)-4-morpholin-4-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1-(2-chloro-3-phenoxy-propyl)-4-morpholino-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-3-phenoxypropyl)-4-(4-morpholinyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chloro-3-phenoxypropyl)-4-morpholin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-3-phenoxy-propyl)-4-morpholino-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C22H25ClN4O4 MolecularWeight: 444.9113

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1N3CCOCC3)C=NN2CC(COC4=CC=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1N3CCOCC3)C=NN2CC(COC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H25ClN4O4/c1-2-30-22(28)19-12-24-21-18(20(19)26-8-10-29-11-9-26)13-25-27(21)14-16(23)15-31-17-6-4-3-5-7-17/h3-7,12-13,16H,2,8-11,14-15H2,1H3