3-[4-methyl-3-(propylsulfamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-methyl-3-(propylsulfamoyl)phenyl]propanoic acid Openeye Name: 3-[4-methyl-3-(propylsulfamoyl)phenyl]propanoic acid CAS Name: 3-[4-methyl-3-(propylsulfamoyl)phenyl]propanoic acid IUPAC Name: 3-[4-methyl-3-(propylsulfamoyl)phenyl]propanoic acid Traditional Name: 3-[4-methyl-3-(propylsulfamoyl)phenyl]propionic acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=C(C=CC(=C1)CCC(=O)O)C

Isomeric SMILES

CCCNS(=O)(=O)C1=C(C=CC(=C1)CCC(=O)O)C

InChI

InChI=1S/C13H19NO4S/c1-3-8-14-19(17,18)12-9-11(5-4-10(12)2)6-7-13(15)16/h4-5,9,14H,3,6-8H2,1-2H3,(H,15,16)