diethyl 1-(4-fluoranyl-2-nitro-phenyl)-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: diethyl 1-(4-fluoranyl-2-nitro-phenyl)-1,2,3-triazole-4,5-dicarboxylate Openeye Name: diethyl 1-(4-fluoro-2-nitro-phenyl)triazole-4,5-dicarboxylate CAS Name: 1-(4-fluoro-2-nitrophenyl)triazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(4-fluoro-2-nitrophenyl)triazole-4,5-dicarboxylate Traditional Name: 1-(4-fluoro-2-nitro-phenyl)triazole-4,5-dicarboxylic acid diethyl ester Formula: C14H13FN4O6 MolecularWeight: 352.274623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13FN4O6/c1-3-24-13(20)11-12(14(21)25-4-2)18(17-16-11)9-6-5-8(15)7-10(9)19(22)23/h5-7H,3-4H2,1-2H3