3-chloranyl-5-methoxy-4-[4-(trifluoromethyloxy)phenyl]sulfonyloxy-benzoic acid

Systemtic Name: 3-chloranyl-5-methoxy-4-[4-(trifluoromethyloxy)phenyl]sulfonyloxy-benzoic acid Openeye Name: 3-chloro-5-methoxy-4-[4-(trifluoromethoxy)phenyl]sulfonyloxy-benzoic acid CAS Name: 3-chloro-5-methoxy-4-[4-(trifluoromethoxy)phenyl]sulfonyloxybenzoic acid IUPAC Name: 3-chloro-5-methoxy-4-[4-(trifluoromethoxy)phenyl]sulfonyloxybenzoic acid Traditional Name: 3-chloro-5-methoxy-4-[4-(trifluoromethoxy)phenyl]sulfonyloxy-benzoic acid Formula: C15H10ClF3O7S MolecularWeight: 426.74891

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C15H10ClF3O7S/c1-24-12-7-8(14(20)21)6-11(16)13(12)26-27(22,23)10-4-2-9(3-5-10)25-15(17,18)19/h2-7H,1H3,(H,20,21)