5-[2,4-bis(fluoranyl)phenyl]-2-sulfooxy-benzoic acid

Systemtic Name: 5-[2,4-bis(fluoranyl)phenyl]-2-sulfooxy-benzoic acid Openeye Name: 5-(2,4-difluorophenyl)-2-sulfooxy-benzoic acid CAS Name: 5-(2,4-difluorophenyl)-2-sulfooxybenzoic acid IUPAC Name: 5-(2,4-difluorophenyl)-2-sulfooxybenzoic acid Traditional Name: 5-(2,4-difluorophenyl)-2-sulfoxy-benzoic acid Formula: C13H8F2O6S MolecularWeight: 330.260826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)OS(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C13H8F2O6S/c14-8-2-3-9(11(15)6-8)7-1-4-12(21-22(18,19)20)10(5-7)13(16)17/h1-6H,(H,16,17)(H,18,19,20)