4-[4-[(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)sulfamoyl]phenyl]benzoic acid

Systemtic Name: 4-[4-[(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)sulfamoyl]phenyl]benzoic acid Openeye Name: 4-[4-[(1-carboxy-2-methyl-propyl)sulfamoyl]phenyl]benzoic acid CAS Name: 4-[4-[(1-hydroxy-3-methyl-1-oxobutan-2-yl)sulfamoyl]phenyl]benzoic acid IUPAC Name: 4-[4-[(1-hydroxy-3-methyl-1-oxobutan-2-yl)sulfamoyl]phenyl]benzoic acid Traditional Name: 4-[4-[(1-carboxy-2-methyl-propyl)sulfamoyl]phenyl]benzoic acid Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO6S/c1-11(2)16(18(22)23)19-26(24,25)15-9-7-13(8-10-15)12-3-5-14(6-4-12)17(20)21/h3-11,16,19H,1-2H3,(H,20,21)(H,22,23)