(4-nitrophenyl) 2-fluoranyl-3,5-dinitro-benzoate

Systemtic Name: (4-nitrophenyl) 2-fluoranyl-3,5-dinitro-benzoate Openeye Name: (4-nitrophenyl) 2-fluoro-3,5-dinitro-benzoate CAS Name: 2-fluoro-3,5-dinitrobenzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-fluoro-3,5-dinitrobenzoate Traditional Name: 2-fluoro-3,5-dinitro-benzoic acid (4-nitrophenyl) ester Formula: C13H6FN3O8 MolecularWeight: 351.200443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)C2=CC(=CC(=C2F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)C2=CC(=CC(=C2F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H6FN3O8/c14-12-10(5-8(16(21)22)6-11(12)17(23)24)13(18)25-9-3-1-7(2-4-9)15(19)20/h1-6H