[2-bromanyl-6-nitro-4-(trifluoromethyl)phenyl] 3-chloranyl-4-fluoranyl-benzoate

Systemtic Name: [2-bromanyl-6-nitro-4-(trifluoromethyl)phenyl] 3-chloranyl-4-fluoranyl-benzoate Openeye Name: [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] 3-chloro-4-fluoro-benzoate CAS Name: 3-chloro-4-fluorobenzoic acid [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] 3-chloro-4-fluorobenzoate Traditional Name: 3-chloro-4-fluoro-benzoic acid [2-bromo-6-nitro-4-(trifluoromethyl)phenyl] ester Formula: C14H5BrClF4NO4 MolecularWeight: 442.544413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)OC2=C(C=C(C=C2Br)C(F)(F)F)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OC2=C(C=C(C=C2Br)C(F)(F)F)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C14H5BrClF4NO4/c15-8-4-7(14(18,19)20)5-11(21(23)24)12(8)25-13(22)6-1-2-10(17)9(16)3-6/h1-5H