5-[2-chloranyl-3,5,6-tris(fluoranyl)-4-methyl-phenoxy]-2-cyano-benzoic acid

Systemtic Name: 5-[2-chloranyl-3,5,6-tris(fluoranyl)-4-methyl-phenoxy]-2-cyano-benzoic acid Openeye Name: 5-(2-chloro-3,5,6-trifluoro-4-methyl-phenoxy)-2-cyano-benzoic acid CAS Name: 5-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-cyanobenzoic acid IUPAC Name: 5-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-cyanobenzoic acid Traditional Name: 5-(2-chloro-3,5,6-trifluoro-4-methyl-phenoxy)-2-cyano-benzoic acid Formula: C15H7ClF3NO3 MolecularWeight: 341.66919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1F)Cl)OC2=CC(=C(C=C2)C#N)C(=O)O)F)F

Isomeric SMILES

CC1=C(C(=C(C(=C1F)Cl)OC2=CC(=C(C=C2)C#N)C(=O)O)F)F

InChI

InChI=1S/C15H7ClF3NO3/c1-6-11(17)10(16)14(13(19)12(6)18)23-8-3-2-7(5-20)9(4-8)15(21)22/h2-4H,1H3,(H,21,22)