3-[4-(1-oxidanylbutan-2-ylsulfamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(1-oxidanylbutan-2-ylsulfamoyl)phenyl]propanoic acid Openeye Name: 3-[4-[1-(hydroxymethyl)propylsulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-(1-hydroxybutan-2-ylsulfamoyl)phenyl]propanoic acid IUPAC Name: 3-[4-(1-hydroxybutan-2-ylsulfamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(1-methylolpropylsulfamoyl)phenyl]propionic acid Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O

Isomeric SMILES

CCC(CO)NS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O

InChI

InChI=1S/C13H19NO5S/c1-2-11(9-15)14-20(18,19)12-6-3-10(4-7-12)5-8-13(16)17/h3-4,6-7,11,14-15H,2,5,8-9H2,1H3,(H,16,17)