2-Iodobenzoylacebutolol
[CAS# 72249-69-5]

Identification

• Name: 2-Iodobenzoylacebutolol
• Synonyms: N-(3-Acetyl-4-(2-Hydroxy-3-((1-Methylethyl)Amino)Propoxy)Phenyl)-2-Iodobenzamide; Ortho-Iodobenzoylacebutolol
• Molecular Formula: C₂₁H₂₅IN₂O₄
• Molecular Weight: 496.34
• CAS Registry Number: 72249-69-5
• SMILES: [125I]C1=CC=CC=C1C(=O)NC2=CC=C(C(=C2)C(=O)C)OCC(CNC(C)C)O
• InChI: 1S/C21H25IN2O4/c1-13(2)23-11-16(26)12-28-20-9-8-15(10-18(20)14(3)25)24-21(27)17-6-4-5-7-19(17)22/h4-10,13,16,23,26H,11-12H2,1-3H3,(H,24,27)/i22-2
• InChIKey: KXNPTVLZWGRHRX-ONBQKKEBSA-N

Properties

• Density: 1.479g/cm³ (Cal.)