bis[4-nitro-3-(trifluoromethyl)phenyl] ethanedioate

Systemtic Name: bis[4-nitro-3-(trifluoromethyl)phenyl] ethanedioate Openeye Name: bis[4-nitro-3-(trifluoromethyl)phenyl] oxalate CAS Name: oxalic acid bis[4-nitro-3-(trifluoromethyl)phenyl] ester IUPAC Name: bis[4-nitro-3-(trifluoromethyl)phenyl] oxalate Traditional Name: oxalic acid bis[4-nitro-3-(trifluoromethyl)phenyl] ester Formula: C16H6F6N2O8 MolecularWeight: 468.217859

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC(=O)C(=O)OC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1OC(=O)C(=O)OC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H6F6N2O8/c17-15(18,19)9-5-7(1-3-11(9)23(27)28)31-13(25)14(26)32-8-2-4-12(24(29)30)10(6-8)16(20,21)22/h1-6H