ethyl 2-(5-ethyl-3-nitro-1,2,4-triazol-1-yl)ethanoate

Systemtic Name: ethyl 2-(5-ethyl-3-nitro-1,2,4-triazol-1-yl)ethanoate Openeye Name: ethyl 2-(5-ethyl-3-nitro-1,2,4-triazol-1-yl)acetate CAS Name: 2-(5-ethyl-3-nitro-1,2,4-triazol-1-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5-ethyl-3-nitro-1,2,4-triazol-1-yl)acetate Traditional Name: 2-(5-ethyl-3-nitro-1,2,4-triazol-1-yl)acetic acid ethyl ester Formula: C8H12N4O4 MolecularWeight: 228.20528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1CC(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC1=NC(=NN1CC(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C8H12N4O4/c1-3-6-9-8(12(14)15)10-11(6)5-7(13)16-4-2/h3-5H2,1-2H3