2-Butyl-1,3-Dioxo-2,3-Dihydro-1H-Isoindole-5-Carboxylic Acid
[CAS# 96296-39-8]

Identification

• Name: 2-Butyl-1,3-Dioxo-2,3-Dihydro-1H-Isoindole-5-Carboxylic Acid
• Synonyms: 2-Butyl-1,3-Dioxo-Isoindoline-5-Carboxylate; 2-Butyl-1,3-Dioxo-5-Isoindolinecarboxylate; 2-Butyl-1,3-Diketo-Isoindoline-5-Carboxylate
• Molecular Formula: C₁₃H₁₂NO₄
• Molecular Weight: 246.24
• CAS Registry Number: 96296-39-8
• SMILES: C1=C(C=CC2=C1C(=O)N(C2=O)CCCC)C([O-])=O
• InChI: 1S/C13H13NO4/c1-2-3-6-14-11(15)9-5-4-8(13(17)18)7-10(9)12(14)16/h4-5,7H,2-3,6H2,1H3,(H,17,18)/p-1
• InChIKey: JPWIWDRTZPWZIL-UHFFFAOYSA-M