4-[bis(fluoranyl)methylsulfonylmethyl]benzoic acid

Systemtic Name: 4-[bis(fluoranyl)methylsulfonylmethyl]benzoic acid Openeye Name: 4-(difluoromethylsulfonylmethyl)benzoic acid CAS Name: 4-(difluoromethylsulfonylmethyl)benzoic acid IUPAC Name: 4-(difluoromethylsulfonylmethyl)benzoic acid Traditional Name: 4-(difluoromethylsulfonylmethyl)benzoic acid Formula: C9H8F2O4S MolecularWeight: 250.219226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)C(F)F)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)C(F)F)C(=O)O

InChI

InChI=1S/C9H8F2O4S/c10-9(11)16(14,15)5-6-1-3-7(4-2-6)8(12)13/h1-4,9H,5H2,(H,12,13)