N-p-Toluenesulfonylimino-3,3'-Dipropionic Acid
[CAS# 5446-58-2]

Identification

• Name: N-p-Toluenesulfonylimino-3,3'-Dipropionic Acid
• Synonyms: 3-[2-Carboxyethyl-(4-Methylphenyl)Sulfonyl-Amino]Propanoic Acid; 3-[2-Carboxyethyl-(4-Methylphenyl)Sulfonyl-Amino]Propionic Acid; N-(2-Carboxyethyl)-N-((4-Methylphenyl)Sulphonyl)-Beta-Alanine
• Molecular Formula: C₁₃H₁₇NO₆S
• Molecular Weight: 315.34
• CAS Registry Number: 5446-58-2
• EINECS: 226-660-1
• SMILES: C1=C([S](N(CCC(O)=O)CCC(O)=O)(=O)=O)C=CC(=C1)C
• InChI: 1S/C13H17NO6S/c1-10-2-4-11(5-3-10)21(19,20)14(8-6-12(15)16)9-7-13(17)18/h2-5H,6-9H2,1H3,(H,15,16)(H,17,18)
• InChIKey: LBANXBGLPMAEBA-UHFFFAOYSA-N