ethyl 1,6-dimethyl-4-(3-nitrophenyl)-3-pyridin-2-yl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 1,6-dimethyl-4-(3-nitrophenyl)-3-pyridin-2-yl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1,6-dimethyl-4-(3-nitrophenyl)-3-(2-pyridyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,6-dimethyl-4-(3-nitrophenyl)-3-(2-pyridinyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1,6-dimethyl-4-(3-nitrophenyl)-3-pyridin-2-yl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,6-dimethyl-4-(3-nitrophenyl)-3-(2-pyridyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(=C(NN2C)C3=CC=CC=N3)C1C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(=C(NN2C)C3=CC=CC=N3)C1C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H21N5O4/c1-4-31-22(28)17-13(2)24-21-19(18(17)14-8-7-9-15(12-14)27(29)30)20(25-26(21)3)16-10-5-6-11-23-16/h5-12,18,25H,4H2,1-3H3