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

Systemtic Name: ethyl 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-azanyl-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: ethyl 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-acetamido-1,2,5-oxadiazol-3-yl)-6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: 1-(4-acetamidofurazan-3-yl)-6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyridine-3-carboxylic acid ethyl ester Formula: C20H19N7O6 MolecularWeight: 453.40816

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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=C3NC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC=CC=C2[N+](=O)[O-])C#N)N)C3=NON=C3NC(=O)C)C

InChI

InChI=1S/C20H19N7O6/c1-4-32-20(29)15-10(2)26(19-18(23-11(3)28)24-33-25-19)17(22)13(9-21)16(15)12-7-5-6-8-14(12)27(30)31/h5-8,16H,4,22H2,1-3H3,(H,23,24,28)