(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-fluoranyl-5-(methylsulfamoyl)benzoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-fluoranyl-5-(methylsulfamoyl)benzoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-fluoro-5-(methylsulfamoyl)benzoate CAS Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-fluoro-5-(methylsulfamoyl)benzoate Traditional Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C17H15BrFNO6S MolecularWeight: 460.271503

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)F)C(=O)OCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C17H15BrFNO6S/c1-20-27(22,23)11-2-3-14(19)12(7-11)17(21)26-9-10-6-15-16(8-13(10)18)25-5-4-24-15/h2-3,6-8,20H,4-5,9H2,1H3