[2,6-dinitro-4-(trifluoromethyl)phenyl] 4-fluoranylbenzoate

Systemtic Name: [2,6-dinitro-4-(trifluoromethyl)phenyl] 4-fluoranylbenzoate Openeye Name: [2,6-dinitro-4-(trifluoromethyl)phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [2,6-dinitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2,6-dinitro-4-(trifluoromethyl)phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [2,6-dinitro-4-(trifluoromethyl)phenyl] ester Formula: C14H6F4N2O6 MolecularWeight: 374.200853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H6F4N2O6/c15-9-3-1-7(2-4-9)13(21)26-12-10(19(22)23)5-8(14(16,17)18)6-11(12)20(24)25/h1-6H