3-nitro-4-[2,2,2-tris(fluoranyl)ethoxy]benzoic acid

Systemtic Name: 3-nitro-4-[2,2,2-tris(fluoranyl)ethoxy]benzoic acid Openeye Name: 3-nitro-4-(2,2,2-trifluoroethoxy)benzoic acid CAS Name: 3-nitro-4-(2,2,2-trifluoroethoxy)benzoic acid IUPAC Name: 3-nitro-4-(2,2,2-trifluoroethoxy)benzoic acid Traditional Name: 3-nitro-4-(2,2,2-trifluoroethoxy)benzoic acid Formula: C9H6F3NO5 MolecularWeight: 265.14285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6F3NO5/c10-9(11,12)4-18-7-2-1-5(8(14)15)3-6(7)13(16)17/h1-3H,4H2,(H,14,15)