2,6-bis(fluoranyl)-3-[methyl(pentyl)sulfamoyl]benzoic acid

Systemtic Name: 2,6-bis(fluoranyl)-3-[methyl(pentyl)sulfamoyl]benzoic acid Openeye Name: 2,6-difluoro-3-[methyl(pentyl)sulfamoyl]benzoic acid CAS Name: 2,6-difluoro-3-[methyl(pentyl)sulfamoyl]benzoic acid IUPAC Name: 2,6-difluoro-3-[methyl(pentyl)sulfamoyl]benzoic acid Traditional Name: 3-[amyl(methyl)sulfamoyl]-2,6-difluoro-benzoic acid Formula: C13H17F2NO4S MolecularWeight: 321.340186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)S(=O)(=O)C1=C(C(=C(C=C1)F)C(=O)O)F

Isomeric SMILES

CCCCCN(C)S(=O)(=O)C1=C(C(=C(C=C1)F)C(=O)O)F

InChI

InChI=1S/C13H17F2NO4S/c1-3-4-5-8-16(2)21(19,20)10-7-6-9(14)11(12(10)15)13(17)18/h6-7H,3-5,8H2,1-2H3,(H,17,18)