5-ethoxycarbonyl-2-(4-nitrophenyl)-1,2,4-triazol-3-olate

Systemtic Name: 5-ethoxycarbonyl-2-(4-nitrophenyl)-1,2,4-triazol-3-olate Openeye Name: 5-ethoxycarbonyl-2-(4-nitrophenyl)-1,2,4-triazol-3-olate CAS Name: 5-ethoxycarbonyl-2-(4-nitrophenyl)-1,2,4-triazol-3-olate IUPAC Name: 5-ethoxycarbonyl-2-(4-nitrophenyl)-1,2,4-triazol-3-olate Traditional Name: 5-carbethoxy-2-(4-nitrophenyl)-1,2,4-triazol-3-olate Formula: C11H9N4O5- MolecularWeight: 277.21296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N4O5/c1-2-20-10(16)9-12-11(17)14(13-9)7-3-5-8(6-4-7)15(18)19/h3-6H,2H2,1H3,(H,12,13,17)/p-1