5-(butylsulfamoyl)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(butylsulfamoyl)benzene-1,3-dicarboxylic acid Openeye Name: 5-(butylsulfamoyl)benzene-1,3-dicarboxylic acid CAS Name: 5-(butylsulfamoyl)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(butylsulfamoyl)benzene-1,3-dicarboxylic acid Traditional Name: 5-(butylsulfamoyl)isophthalic acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC(=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC(=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C12H15NO6S/c1-2-3-4-13-20(18,19)10-6-8(11(14)15)5-9(7-10)12(16)17/h5-7,13H,2-4H2,1H3,(H,14,15)(H,16,17)