ethyl 5-chloranyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylate

Systemtic Name: ethyl 5-chloranyl-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylate Openeye Name: ethyl 5-chloro-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylate CAS Name: 5-chloro-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylate Traditional Name: 5-chloro-1-(4-nitrophenyl)-1,2,4-triazole-3-carboxylic acid ethyl ester Formula: C11H9ClN4O4 MolecularWeight: 296.66656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9ClN4O4/c1-2-20-10(17)9-13-11(12)15(14-9)7-3-5-8(6-4-7)16(18)19/h3-6H,2H2,1H3