4-tert-butyl-2-propan-2-yl-6-(trifluoromethylsulfonyloxy)benzoic acid

Systemtic Name: 4-tert-butyl-2-propan-2-yl-6-(trifluoromethylsulfonyloxy)benzoic acid Openeye Name: 4-tert-butyl-2-isopropyl-6-(trifluoromethylsulfonyloxy)benzoic acid CAS Name: 4-tert-butyl-2-propan-2-yl-6-(trifluoromethylsulfonyloxy)benzoic acid IUPAC Name: 4-tert-butyl-2-propan-2-yl-6-(trifluoromethylsulfonyloxy)benzoic acid Traditional Name: 4-tert-butyl-2-isopropyl-6-triflyloxy-benzoic acid Formula: C15H19F3O5S MolecularWeight: 368.36857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC(=C1)C(C)(C)C)OS(=O)(=O)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=CC(=C1)C(C)(C)C)OS(=O)(=O)C(F)(F)F)C(=O)O

InChI

InChI=1S/C15H19F3O5S/c1-8(2)10-6-9(14(3,4)5)7-11(12(10)13(19)20)23-24(21,22)15(16,17)18/h6-8H,1-5H3,(H,19,20)