2,6-bis(fluoranyl)-3-(2-methylpropylsulfonyl)benzoic acid

Systemtic Name: 2,6-bis(fluoranyl)-3-(2-methylpropylsulfonyl)benzoic acid Openeye Name: 2,6-difluoro-3-isobutylsulfonyl-benzoic acid CAS Name: 2,6-difluoro-3-(2-methylpropylsulfonyl)benzoic acid IUPAC Name: 2,6-difluoro-3-(2-methylpropylsulfonyl)benzoic acid Traditional Name: 2,6-difluoro-3-isobutylsulfonyl-benzoic acid Formula: C11H12F2O4S MolecularWeight: 278.272386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12F2O4S/c1-6(2)5-18(16,17)8-4-3-7(12)9(10(8)13)11(14)15/h3-4,6H,5H2,1-2H3,(H,14,15)