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The molecular formula of the compound is C11H14ClNO4S.
The molecular weight of the compound is 291.75 g/mol.
The IUPAC name of the compound is 3-(tert-butylsulfamoyl)-4-chlorobenzoic acid.
The InChI of the compound is InChI=1S/C11H14ClNO4S/c1-11(2,3)13-18(16,17)9-6-7(10(14)15)4-5-8(9)12/h4-6,13H,1-3H3,(H,14,15).
The InChIKey of the compound is CICPHGOQDCGVPX-UHFFFAOYSA-N.
The canonical SMILES of the compound is CC(C)(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)Cl.
The CAS number of the compound is 59815-50-8.
The ChEMBL ID of the compound is CHEMBL1534867.
Yes, the compound is canonicalized.
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