2-[[4-(butan-2-ylsulfamoyl)phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[4-(butan-2-ylsulfamoyl)phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[4-(sec-butylsulfamoyl)benzoyl]amino]terephthalic acid CAS Name: 2-[[[4-(butan-2-ylsulfamoyl)phenyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[4-(butan-2-ylsulfamoyl)benzoyl]amino]terephthalic acid Traditional Name: 2-[[4-(sec-butylsulfamoyl)benzoyl]amino]terephthalic acid Formula: C19H20N2O7S MolecularWeight: 420.4363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C19H20N2O7S/c1-3-11(2)21-29(27,28)14-7-4-12(5-8-14)17(22)20-16-10-13(18(23)24)6-9-15(16)19(25)26/h4-11,21H,3H2,1-2H3,(H,20,22)(H,23,24)(H,25,26)