methyl 2-fluoranyl-3-(3-nitro-1,2,4-triazol-1-yl)propanoate

Systemtic Name: methyl 2-fluoranyl-3-(3-nitro-1,2,4-triazol-1-yl)propanoate Openeye Name: methyl 2-fluoro-3-(3-nitro-1,2,4-triazol-1-yl)propanoate CAS Name: 2-fluoro-3-(3-nitro-1,2,4-triazol-1-yl)propanoic acid methyl ester IUPAC Name: methyl 2-fluoro-3-(3-nitro-1,2,4-triazol-1-yl)propanoate Traditional Name: 2-fluoro-3-(3-nitro-1,2,4-triazol-1-yl)propionic acid methyl ester Formula: C6H7FN4O4 MolecularWeight: 218.142583

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1C=NC(=N1)[N+](=O)[O-])F

Isomeric SMILES

COC(=O)C(CN1C=NC(=N1)[N+](=O)[O-])F

InChI

InChI=1S/C6H7FN4O4/c1-15-5(12)4(7)2-10-3-8-6(9-10)11(13)14/h3-4H,2H2,1H3