ethyl 1-(2,4-dinitrophenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(2,4-dinitrophenyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(2,4-dinitrophenyl)triazole-4-carboxylate CAS Name: 1-(2,4-dinitrophenyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,4-dinitrophenyl)triazole-4-carboxylate Traditional Name: 1-(2,4-dinitrophenyl)triazole-4-carboxylic acid ethyl ester Formula: C11H9N5O6 MolecularWeight: 307.21906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=N1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN(N=N1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H9N5O6/c1-2-22-11(17)8-6-14(13-12-8)9-4-3-7(15(18)19)5-10(9)16(20)21/h3-6H,2H2,1H3