5-[2-chloranyl-1,2,2-tris(fluoranyl)ethyl]-2-nitro-3-phenoxy-benzoic acid

Systemtic Name: 5-[2-chloranyl-1,2,2-tris(fluoranyl)ethyl]-2-nitro-3-phenoxy-benzoic acid Openeye Name: 5-(2-chloro-1,2,2-trifluoro-ethyl)-2-nitro-3-phenoxy-benzoic acid CAS Name: 5-(2-chloro-1,2,2-trifluoroethyl)-2-nitro-3-phenoxybenzoic acid IUPAC Name: 5-(2-chloro-1,2,2-trifluoroethyl)-2-nitro-3-phenoxybenzoic acid Traditional Name: 5-(2-chloro-1,2,2-trifluoro-ethyl)-2-nitro-3-phenoxy-benzoic acid Formula: C15H9ClF3NO5 MolecularWeight: 375.68387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9ClF3NO5/c16-15(18,19)13(17)8-6-10(14(21)22)12(20(23)24)11(7-8)25-9-4-2-1-3-5-9/h1-7,13H,(H,21,22)