(4-bromanyl-2-fluoranyl-phenyl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (4-bromo-2-fluoro-phenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (4-bromo-2-fluorophenyl) ester IUPAC Name: (4-bromo-2-fluorophenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (4-bromo-2-fluoro-phenyl) ester Formula: C13H6BrClFNO4 MolecularWeight: 374.546443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H6BrClFNO4/c14-8-2-4-12(10(16)6-8)21-13(18)7-1-3-9(15)11(5-7)17(19)20/h1-6H