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

Systemtic Name: 2-[[4-(propan-2-ylsulfamoyl)phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[4-(isopropylsulfamoyl)benzoyl]amino]terephthalic acid CAS Name: 2-[[oxo-[4-(propan-2-ylsulfamoyl)phenyl]methyl]amino]terephthalic acid IUPAC Name: 2-[[4-(propan-2-ylsulfamoyl)benzoyl]amino]terephthalic acid Traditional Name: 2-[[4-(isopropylsulfamoyl)benzoyl]amino]terephthalic acid Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(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/C18H18N2O7S/c1-10(2)20-28(26,27)13-6-3-11(4-7-13)16(21)19-15-9-12(17(22)23)5-8-14(15)18(24)25/h3-10,20H,1-2H3,(H,19,21)(H,22,23)(H,24,25)