3-[4-[bis(fluoranyl)methylsulfonyl]phenyl]sulfanylpropanoic acid

Systemtic Name: 3-[4-[bis(fluoranyl)methylsulfonyl]phenyl]sulfanylpropanoic acid Openeye Name: 3-[4-(difluoromethylsulfonyl)phenyl]sulfanylpropanoic acid CAS Name: 3-[[4-(difluoromethylsulfonyl)phenyl]thio]propanoic acid IUPAC Name: 3-[4-(difluoromethylsulfonyl)phenyl]sulfanylpropanoic acid Traditional Name: 3-[[4-(difluoromethylsulfonyl)phenyl]thio]propionic acid Formula: C10H10F2O4S2 MolecularWeight: 296.310806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCC(=O)O)S(=O)(=O)C(F)F

Isomeric SMILES

C1=CC(=CC=C1SCCC(=O)O)S(=O)(=O)C(F)F

InChI

InChI=1S/C10H10F2O4S2/c11-10(12)18(15,16)8-3-1-7(2-4-8)17-6-5-9(13)14/h1-4,10H,5-6H2,(H,13,14)