[4-(Carbamoylsulphonyl)Phenethyl][(5-Methylisoxazol-3-Yl)Carbonyl]Ammonium Chloride
[CAS# 80228-91-7]

Identification

• Name: [4-(Carbamoylsulphonyl)Phenethyl][(5-Methylisoxazol-3-Yl)Carbonyl]Ammonium Chloride
• Synonyms: 2-(4-Carbamoylsulfonylphenyl)Ethyl-(5-Methylisoxazole-3-Carbonyl)Ammonium Chloride; 2-(4-Carbamoylsulfonylphenyl)Ethyl-[(5-Methyl-3-Isoxazolyl)-Oxomethyl]Ammonium Chloride; 2-(4-Aminocarbonylsulfonylphenyl)Ethyl-[(5-Methyl-1,2-Oxazol-3-Yl)Carbonyl]Azanium Chloride
• Molecular Formula: C₁₄H₁₆ClN₃O₅S
• Molecular Weight: 373.81
• CAS Registry Number: 80228-91-7
• EINECS: 279-428-7
• SMILES: C1=C([S](=O)(=O)C(=O)N)C=CC(=C1)CC[NH2+]C(=O)C2=NOC(=C2)C.[Cl-]
• InChI: 1S/C14H15N3O5S.ClH/c1-9-8-12(17-22-9)13(18)16-7-6-10-2-4-11(5-3-10)23(20,21)14(15)19;/h2-5,8H,6-7H2,1H3,(H2,15,19)(H,16,18);1H
• InChIKey: VUTUJTJQGIJOBJ-UHFFFAOYSA-N