4-(4'-(((3,4-Dihydro-3-Hydroxy-2H-1,5-Benzodioxepin-3-Yl)Methyl)Thio)(1,1'-Biphenyl)-4-Yl)-2,4-Dioxobutanoic Acid
[CAS# 83085-97-6]

Identification

• Name: 4-(4'-(((3,4-Dihydro-3-Hydroxy-2H-1,5-Benzodioxepin-3-Yl)Methyl)Thio)(1,1'-Biphenyl)-4-Yl)-2,4-Dioxobutanoic Acid
• Synonyms: 4-[4-[4-[(3-Hydroxy-2,4-Dihydro-1,5-Benzodioxepin-3-Yl)Methylsulfanyl]Phenyl]Phenyl]-2,4-Dioxo-Butanoic Acid; 4-[4-[4-[(3-Hydroxy-2,4-Dihydro-1,5-Benzodioxepin-3-Yl)Methylthio]Phenyl]Phenyl]-2,4-Dioxobutanoic Acid; 4-[4-[4-[(3-Hydroxy-2,4-Dihydro-1,5-Benzodioxepin-3-Yl)Methylthio]Phenyl]Phenyl]-2,4-Diketo-Butyric Acid
• Molecular Formula: C₂₆H₂₂O₇S
• Molecular Weight: 478.52
• CAS Registry Number: 83085-97-6
• SMILES: C2=C1OCC(O)(COC1=CC=C2)CSC4=CC=C(C3=CC=C(C(=O)CC(=O)C(=O)O)C=C3)C=C4
• InChI: 1S/C26H22O7S/c27-21(13-22(28)25(29)30)19-7-5-17(6-8-19)18-9-11-20(12-10-18)34-16-26(31)14-32-23-3-1-2-4-24(23)33-15-26/h1-12,31H,13-16H2,(H,29,30)
• InChIKey: UEOJQYVDBAHYRQ-UHFFFAOYSA-N