[2-nitro-4-(trifluoromethyl)phenyl] 2,6-dimethoxy-3-nitro-benzoate

Systemtic Name: [2-nitro-4-(trifluoromethyl)phenyl] 2,6-dimethoxy-3-nitro-benzoate Openeye Name: [2-nitro-4-(trifluoromethyl)phenyl] 2,6-dimethoxy-3-nitro-benzoate CAS Name: 2,6-dimethoxy-3-nitrobenzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-nitro-4-(trifluoromethyl)phenyl] 2,6-dimethoxy-3-nitrobenzoate Traditional Name: 2,6-dimethoxy-3-nitro-benzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester Formula: C16H11F3N2O8 MolecularWeight: 416.26235

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H11F3N2O8/c1-27-12-6-4-9(20(23)24)14(28-2)13(12)15(22)29-11-5-3-8(16(17,18)19)7-10(11)21(25)26/h3-7H,1-2H3