4-[(2-methylsulfanylphenyl)sulfamoyl]butanoic acid

Systemtic Name: 4-[(2-methylsulfanylphenyl)sulfamoyl]butanoic acid Openeye Name: 4-[(2-methylsulfanylphenyl)sulfamoyl]butanoic acid CAS Name: 4-[[2-(methylthio)phenyl]sulfamoyl]butanoic acid IUPAC Name: 4-[(2-methylsulfanylphenyl)sulfamoyl]butanoic acid Traditional Name: 4-[[2-(methylthio)phenyl]sulfamoyl]butyric acid Formula: C11H15NO4S2 MolecularWeight: 289.3711

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NS(=O)(=O)CCCC(=O)O

Isomeric SMILES

CSC1=CC=CC=C1NS(=O)(=O)CCCC(=O)O

InChI

InChI=1S/C11H15NO4S2/c1-17-10-6-3-2-5-9(10)12-18(15,16)8-4-7-11(13)14/h2-3,5-6,12H,4,7-8H2,1H3,(H,13,14)