(2-bromanyl-4-methyl-phenyl) 3,5-bis(fluoranyl)benzenesulfonate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 3,5-bis(fluoranyl)benzenesulfonate Openeye Name: (2-bromo-4-methyl-phenyl) 3,5-difluorobenzenesulfonate CAS Name: 3,5-difluorobenzenesulfonic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 3,5-difluorobenzenesulfonate Traditional Name: 3,5-difluorobenzenesulfonic acid (2-bromo-4-methyl-phenyl) ester Formula: C13H9BrF2O3S MolecularWeight: 363.174566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC(=CC(=C2)F)F)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC(=CC(=C2)F)F)Br

InChI

InChI=1S/C13H9BrF2O3S/c1-8-2-3-13(12(14)4-8)19-20(17,18)11-6-9(15)5-10(16)7-11/h2-7H,1H3