[2-nitro-4-(trifluoromethyl)phenyl] 4-chloranyl-3-nitro-benzoate

Systemtic Name: [2-nitro-4-(trifluoromethyl)phenyl] 4-chloranyl-3-nitro-benzoate Openeye Name: [2-nitro-4-(trifluoromethyl)phenyl] 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-nitro-4-(trifluoromethyl)phenyl] 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester Formula: C14H6ClF3N2O6 MolecularWeight: 390.65545

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C14H6ClF3N2O6/c15-9-3-1-7(5-10(9)19(22)23)13(21)26-12-4-2-8(14(16,17)18)6-11(12)20(24)25/h1-6H