ethyl 4-(2,1,3-benzoxadiazol-4-yl)-6-phenyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-(2,1,3-benzoxadiazol-4-yl)-6-phenyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(2,1,3-benzoxadiazol-4-yl)-6-phenyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-(2,1,3-benzoxadiazol-4-yl)-6-phenyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,1,3-benzoxadiazol-4-yl)-6-phenyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-benzofurazan-4-yl-6-phenyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC4=NON=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC4=NON=C43)C5=CC=CC=C5

InChI

InChI=1S/C21H17N5O3/c1-2-28-21(27)17-16(13-9-6-10-15-19(13)26-29-25-15)14-11-22-24-20(14)23-18(17)12-7-4-3-5-8-12/h3-11,16H,2H2,1H3,(H2,22,23,24)