2-[[4-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[4-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[4-(prop-2-ynylsulfamoyl)benzoyl]amino]terephthalic acid CAS Name: 2-[[oxo-[4-(prop-2-ynylsulfamoyl)phenyl]methyl]amino]terephthalic acid IUPAC Name: 2-[[4-(prop-2-ynylsulfamoyl)benzoyl]amino]terephthalic acid Traditional Name: 2-[[4-(propargylsulfamoyl)benzoyl]amino]terephthalic acid Formula: C18H14N2O7S MolecularWeight: 402.37796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O7S/c1-2-9-19-28(26,27)13-6-3-11(4-7-13)16(21)20-15-10-12(17(22)23)5-8-14(15)18(24)25/h1,3-8,10,19H,9H2,(H,20,21)(H,22,23)(H,24,25)