2-[4-[bis(fluoranyl)methylsulfonyl]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[4-[bis(fluoranyl)methylsulfonyl]phenyl]sulfanylethanoic acid Openeye Name: 2-[4-(difluoromethylsulfonyl)phenyl]sulfanylacetic acid CAS Name: 2-[[4-(difluoromethylsulfonyl)phenyl]thio]acetic acid IUPAC Name: 2-[4-(difluoromethylsulfonyl)phenyl]sulfanylacetic acid Traditional Name: 2-[[4-(difluoromethylsulfonyl)phenyl]thio]acetic acid Formula: C9H8F2O4S2 MolecularWeight: 282.284226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC(=O)O)S(=O)(=O)C(F)F

Isomeric SMILES

C1=CC(=CC=C1SCC(=O)O)S(=O)(=O)C(F)F

InChI

InChI=1S/C9H8F2O4S2/c10-9(11)17(14,15)7-3-1-6(2-4-7)16-5-8(12)13/h1-4,9H,5H2,(H,12,13)