3-[3,4-bis(fluoranyl)phenyl]sulfonyloxybenzoic acid

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]sulfonyloxybenzoic acid Openeye Name: 3-(3,4-difluorophenyl)sulfonyloxybenzoic acid CAS Name: 3-(3,4-difluorophenyl)sulfonyloxybenzoic acid IUPAC Name: 3-(3,4-difluorophenyl)sulfonyloxybenzoic acid Traditional Name: 3-(3,4-difluorophenyl)sulfonyloxybenzoic acid Formula: C13H8F2O5S MolecularWeight: 314.261426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8F2O5S/c14-11-5-4-10(7-12(11)15)21(18,19)20-9-3-1-2-8(6-9)13(16)17/h1-7H,(H,16,17)