ethyl 3-(4-bromophenyl)-6-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)-6-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 3-(4-bromophenyl)-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 3-(4-bromophenyl)-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromophenyl)-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 3-(4-bromophenyl)-6-keto-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C21H16BrN3O3 MolecularWeight: 438.27404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(NN(C2=NC1=O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)C1=CC2=C(NN(C2=NC1=O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN3O3/c1-2-28-21(27)17-12-16-18(13-8-10-14(22)11-9-13)24-25(19(16)23-20(17)26)15-6-4-3-5-7-15/h3-12,24H,2H2,1H3