ethyl 7-chloranyl-8-nitro-4-oxidanylidene-5H-[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylate

Systemtic Name: ethyl 7-chloranyl-8-nitro-4-oxidanylidene-5H-[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylate Openeye Name: ethyl 7-chloro-8-nitro-4-oxo-5H-[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylate CAS Name: 7-chloro-8-nitro-4-oxo-5H-[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-8-nitro-4-oxo-5H-[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylate Traditional Name: 7-chloro-4-keto-8-nitro-5H-[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylic acid ethyl ester Formula: C12H8ClN5O5 MolecularWeight: 337.67542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN2C3=CC(=C(C=C3NC(=O)C2=N1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN2C3=CC(=C(C=C3NC(=O)C2=N1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H8ClN5O5/c1-2-23-12(20)9-15-10-11(19)14-6-3-5(13)7(18(21)22)4-8(6)17(10)16-9/h3-4H,2H2,1H3,(H,14,19)