[2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-bromanyl-3-nitro-benzoate

Systemtic Name: [2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-bromanyl-3-nitro-benzoate Openeye Name: [2-(2,5-difluorophenyl)-2-oxo-ethyl] 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid [2-(2,5-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-difluorophenyl)-2-oxoethyl] 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid [2-(2,5-difluorophenyl)-2-keto-ethyl] ester Formula: C15H8BrF2NO5 MolecularWeight: 400.128526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H8BrF2NO5/c16-11-3-1-8(5-13(11)19(22)23)15(21)24-7-14(20)10-6-9(17)2-4-12(10)18/h1-6H,7H2