methyl 4-(4-nitrophenyl)-3-oxidanylidene-2-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate

Systemtic Name: methyl 4-(4-nitrophenyl)-3-oxidanylidene-2-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate Openeye Name: methyl 4-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate CAS Name: 4-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate Traditional Name: 3-keto-4-(4-nitrophenyl)-2-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid methyl ester Formula: C20H14N4O5 MolecularWeight: 390.34896

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=C(C(=C1)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N(N2)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NC2=C(C(=C1)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N(N2)C4=CC=CC=C4

InChI

InChI=1S/C20H14N4O5/c1-29-20(26)16-11-15(12-7-9-14(10-8-12)24(27)28)17-18(21-16)22-23(19(17)25)13-5-3-2-4-6-13/h2-11H,1H3,(H,21,22)