3-[3,4-bis(fluoranyl)phenyl]sulfonylpropanoate

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]sulfonylpropanoate Openeye Name: 3-(3,4-difluorophenyl)sulfonylpropanoate CAS Name: 3-(3,4-difluorophenyl)sulfonylpropanoate IUPAC Name: 3-(3,4-difluorophenyl)sulfonylpropanoate Traditional Name: 3-(3,4-difluorophenyl)sulfonylpropionate Formula: C9H7F2O4S- MolecularWeight: 249.211286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)CCC(=O)[O-])F)F

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)CCC(=O)[O-])F)F

InChI

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