2-azanyl-3-nitro-6-[2,2,2-tris(fluoranyl)ethoxy]benzoic acid

Systemtic Name: 2-azanyl-3-nitro-6-[2,2,2-tris(fluoranyl)ethoxy]benzoic acid Openeye Name: 2-amino-3-nitro-6-(2,2,2-trifluoroethoxy)benzoic acid CAS Name: 2-amino-3-nitro-6-(2,2,2-trifluoroethoxy)benzoic acid IUPAC Name: 2-amino-3-nitro-6-(2,2,2-trifluoroethoxy)benzoic acid Traditional Name: 2-amino-3-nitro-6-(2,2,2-trifluoroethoxy)benzoic acid Formula: C9H7F3N2O5 MolecularWeight: 280.15749

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7F3N2O5/c10-9(11,12)3-19-5-2-1-4(14(17)18)7(13)6(5)8(15)16/h1-2H,3,13H2,(H,15,16)