3-[2,2-bis(bromanyl)-1,1-bis(fluoranyl)ethoxy]-2,4,5-tris(fluoranyl)-6-nitro-benzoic acid

Systemtic Name: 3-[2,2-bis(bromanyl)-1,1-bis(fluoranyl)ethoxy]-2,4,5-tris(fluoranyl)-6-nitro-benzoic acid Openeye Name: 3-(2,2-dibromo-1,1-difluoro-ethoxy)-2,4,5-trifluoro-6-nitro-benzoic acid CAS Name: 3-(2,2-dibromo-1,1-difluoroethoxy)-2,4,5-trifluoro-6-nitrobenzoic acid IUPAC Name: 3-(2,2-dibromo-1,1-difluoroethoxy)-2,4,5-trifluoro-6-nitrobenzoic acid Traditional Name: 3-(2,2-dibromo-1,1-difluoro-ethoxy)-2,4,5-trifluoro-6-nitro-benzoic acid Formula: C9H2Br2F5NO5 MolecularWeight: 458.915896

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Descriptors Computed from Structure

Canonical SMILES:

C1(=C(C(=C(C(=C1F)OC(C(Br)Br)(F)F)F)F)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1(=C(C(=C(C(=C1F)OC(C(Br)Br)(F)F)F)F)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C9H2Br2F5NO5/c10-8(11)9(15,16)22-6-2(12)1(7(18)19)5(17(20)21)3(13)4(6)14/h8H,(H,18,19)