4-sulfanyl-3-(trifluoromethyloxy)benzoic acid

Systemtic Name: 4-sulfanyl-3-(trifluoromethyloxy)benzoic acid Openeye Name: 4-sulfanyl-3-(trifluoromethoxy)benzoic acid CAS Name: 4-mercapto-3-(trifluoromethoxy)benzoic acid IUPAC Name: 4-sulfanyl-3-(trifluoromethoxy)benzoic acid Traditional Name: 4-mercapto-3-(trifluoromethoxy)benzoic acid Formula: C8H5F3O3S MolecularWeight: 238.18371

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)OC(F)(F)F)S

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)OC(F)(F)F)S

InChI

InChI=1S/C8H5F3O3S/c9-8(10,11)14-5-3-4(7(12)13)1-2-6(5)15/h1-3,15H,(H,12,13)