3,6-bis(fluoranyl)-2-methyl-benzenesulfonic acid

Systemtic Name: 3,6-bis(fluoranyl)-2-methyl-benzenesulfonic acid Openeye Name: 3,6-difluoro-2-methyl-benzenesulfonic acid CAS Name: 3,6-difluoro-2-methylbenzenesulfonic acid IUPAC Name: 3,6-difluoro-2-methylbenzenesulfonic acid Traditional Name: 3,6-difluoro-2-methyl-besylic acid Formula: C7H6F2O3S MolecularWeight: 208.182546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1S(=O)(=O)O)F)F

Isomeric SMILES

CC1=C(C=CC(=C1S(=O)(=O)O)F)F

InChI

InChI=1S/C7H6F2O3S/c1-4-5(8)2-3-6(9)7(4)13(10,11)12/h2-3H,1H3,(H,10,11,12)