2-[[3-(prop-2-enylsulfamoyl)phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[3-(prop-2-enylsulfamoyl)phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[3-(allylsulfamoyl)benzoyl]amino]terephthalic acid CAS Name: 2-[[oxo-[3-(prop-2-enylsulfamoyl)phenyl]methyl]amino]terephthalic acid IUPAC Name: 2-[[3-(prop-2-enylsulfamoyl)benzoyl]amino]terephthalic acid Traditional Name: 2-[[3-(allylsulfamoyl)benzoyl]amino]terephthalic acid Formula: C18H16N2O7S MolecularWeight: 404.39384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O7S/c1-2-8-19-28(26,27)13-5-3-4-11(9-13)16(21)20-15-10-12(17(22)23)6-7-14(15)18(24)25/h2-7,9-10,19H,1,8H2,(H,20,21)(H,22,23)(H,24,25)