ethyl 6-azanyl-1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate

Systemtic Name: ethyl 6-azanyl-1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: ethyl 6-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 6-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: 6-amino-1-(4-aminofurazan-3-yl)-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid ethyl ester Formula: C18H17N7O5 MolecularWeight: 411.37148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C#N)N)C3=NON=C3N)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C#N)N)C3=NON=C3N)C

InChI

InChI=1S/C18H17N7O5/c1-3-29-18(26)13-9(2)24(17-15(20)22-30-23-17)16(21)12(8-19)14(13)10-5-4-6-11(7-10)25(27)28/h4-7,14H,3,21H2,1-2H3,(H2,20,22)