2-[4-[Bis[(2,5-Dioxopyrrole-1-Carbonyl)Amino]Methyl]Phenoxy]Acetic Acid
[CAS# 7253-21-6]

Identification

• Name: 2-[4-[Bis[(2,5-Dioxopyrrole-1-Carbonyl)Amino]Methyl]Phenoxy]Acetic Acid
• Synonyms: 2-[4-[Bis[[(2,5-Dioxo-1-Pyrrolyl)-Oxomethyl]Amino]Methyl]Phenoxy]Acetic Acid; 2-[4-[Bis[(2,5-Diketo3-Pyrroline-1-Carbonyl)Amino]Methyl]Phenoxy]Acetic Acid; 2-[4-[Bis[(2,5-Dioxopyrrol-1-Yl)Carbonylamino]Methyl]Phenoxy]Ethanoic Acid
• Molecular Formula: C₁₉H₁₄N₄O₉
• Molecular Weight: 442.34
• CAS Registry Number: 7253-21-6
• SMILES: C1=C(OCC(=O)O)C=CC(=C1)C(NC(N2C(=O)C=CC2=O)=O)NC(N3C(=O)C=CC3=O)=O
• InChI: 1S/C19H14N4O9/c24-12-5-6-13(25)22(12)18(30)20-17(21-19(31)23-14(26)7-8-15(23)27)10-1-3-11(4-2-10)32-9-16(28)29/h1-8,17H,9H2,(H,20,30)(H,21,31)(H,28,29)
• InChIKey: PJANYUSOAUNHDW-UHFFFAOYSA-N

Properties

• Density: 1.677g/cm³ (Cal.)