ethyl 3-methyl-1-(4-nitrophenyl)-6-pyridin-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: ethyl 3-methyl-1-(4-nitrophenyl)-6-pyridin-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: ethyl 3-methyl-1-(4-nitrophenyl)-6-(2-pyridyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-1-(4-nitrophenyl)-6-(2-pyridinyl)-4-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-1-(4-nitrophenyl)-6-pyridin-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-1-(4-nitrophenyl)-6-(2-pyridyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid ethyl ester Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=C1C(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C)C4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=C1C(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C)C4=CC=CC=N4

InChI

InChI=1S/C21H17N5O4/c1-3-30-21(27)16-12-18(17-6-4-5-11-22-17)23-20-19(16)13(2)24-25(20)14-7-9-15(10-8-14)26(28)29/h4-12H,3H2,1-2H3