2-[2,3,6-tris(fluoranyl)-4-methyl-phenyl]ethanoic acid

Systemtic Name: 2-[2,3,6-tris(fluoranyl)-4-methyl-phenyl]ethanoic acid Openeye Name: 2-(2,3,6-trifluoro-4-methyl-phenyl)acetic acid CAS Name: 2-(2,3,6-trifluoro-4-methylphenyl)acetic acid IUPAC Name: 2-(2,3,6-trifluoro-4-methylphenyl)acetic acid Traditional Name: 2-(2,3,6-trifluoro-4-methyl-phenyl)acetic acid Formula: C9H7F3O2 MolecularWeight: 204.14589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1F)F)CC(=O)O)F

Isomeric SMILES

CC1=CC(=C(C(=C1F)F)CC(=O)O)F

InChI

InChI=1S/C9H7F3O2/c1-4-2-6(10)5(3-7(13)14)9(12)8(4)11/h2H,3H2,1H3,(H,13,14)