2,3,4-tris(fluoranyl)-6-pentyl-5-(trifluoromethyl)benzoic acid

Systemtic Name: 2,3,4-tris(fluoranyl)-6-pentyl-5-(trifluoromethyl)benzoic acid Openeye Name: 2,3,4-trifluoro-6-pentyl-5-(trifluoromethyl)benzoic acid CAS Name: 2,3,4-trifluoro-6-pentyl-5-(trifluoromethyl)benzoic acid IUPAC Name: 2,3,4-trifluoro-6-pentyl-5-(trifluoromethyl)benzoic acid Traditional Name: 2-amyl-4,5,6-trifluoro-3-(trifluoromethyl)benzoic acid Formula: C13H12F6O2 MolecularWeight: 314.223599

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C(=C1C(F)(F)F)F)F)F)C(=O)O

Isomeric SMILES

CCCCCC1=C(C(=C(C(=C1C(F)(F)F)F)F)F)C(=O)O

InChI

InChI=1S/C13H12F6O2/c1-2-3-4-5-6-7(12(20)21)9(14)11(16)10(15)8(6)13(17,18)19/h2-5H2,1H3,(H,20,21)