ethyl 6-cyclopropyl-4-(2-nitrophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 6-cyclopropyl-4-(2-nitrophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 6-cyclopropyl-4-(2-nitrophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 6-cyclopropyl-4-(2-nitrophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-cyclopropyl-4-(2-nitrophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 6-cyclopropyl-4-(2-nitrophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC=C3[N+](=O)[O-])C4CC4

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC=C3[N+](=O)[O-])C4CC4

InChI

InChI=1S/C18H18N4O4/c1-2-26-18(23)15-14(11-5-3-4-6-13(11)22(24)25)12-9-19-21-17(12)20-16(15)10-7-8-10/h3-6,9-10,14H,2,7-8H2,1H3,(H2,19,20,21)