2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[5-(diethylsulfamoyl)-2-methyl-benzoyl]amino]terephthalic acid CAS Name: 2-[[[5-(diethylsulfamoyl)-2-methylphenyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[5-(diethylsulfamoyl)-2-methylbenzoyl]amino]terephthalic acid Traditional Name: 2-[[5-(diethylsulfamoyl)-2-methyl-benzoyl]amino]terephthalic acid Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C20H22N2O7S/c1-4-22(5-2)30(28,29)14-8-6-12(3)16(11-14)18(23)21-17-10-13(19(24)25)7-9-15(17)20(26)27/h6-11H,4-5H2,1-3H3,(H,21,23)(H,24,25)(H,26,27)