2-oxidanyl-5-[[2-oxidanyl-4-(1-oxidanylidenebutan-2-ylcarbamoyl)phenyl]methylsulfamoyl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[[2-oxidanyl-4-(1-oxidanylidenebutan-2-ylcarbamoyl)phenyl]methylsulfamoyl]benzoic acid Openeye Name: 5-[[4-(1-formylpropylcarbamoyl)-2-hydroxy-phenyl]methylsulfamoyl]-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-5-[[2-hydroxy-4-[oxo-(1-oxobutan-2-ylamino)methyl]phenyl]methylsulfamoyl]benzoic acid IUPAC Name: 2-hydroxy-5-[[2-hydroxy-4-(1-oxobutan-2-ylcarbamoyl)phenyl]methylsulfamoyl]benzoic acid Traditional Name: 5-[[4-(1-formylpropylcarbamoyl)-2-hydroxy-benzyl]sulfamoyl]-2-hydroxy-benzoic acid Formula: C19H20N2O8S MolecularWeight: 436.4357

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=O)NC(=O)C1=CC(=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)O)O

Isomeric SMILES

CCC(C=O)NC(=O)C1=CC(=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)O)O

InChI

InChI=1S/C19H20N2O8S/c1-2-13(10-22)21-18(25)11-3-4-12(17(24)7-11)9-20-30(28,29)14-5-6-16(23)15(8-14)19(26)27/h3-8,10,13,20,23-24H,2,9H2,1H3,(H,21,25)(H,26,27)