2-[[3-[2-[bis(4-hydroxyphenyl)methylsulfanyl]ethyl]-2-methyl-1-benzofuran-7-yl]oxy]ethanoate

Systemtic Name: 2-[[3-[2-[bis(4-hydroxyphenyl)methylsulfanyl]ethyl]-2-methyl-1-benzofuran-7-yl]oxy]ethanoate Openeye Name: 2-[3-[2-[bis(4-hydroxyphenyl)methylsulfanyl]ethyl]-2-methyl-benzofuran-7-yl]oxyacetate CAS Name: 2-[[3-[2-[bis(4-hydroxyphenyl)methylthio]ethyl]-2-methyl-7-benzofuranyl]oxy]acetate IUPAC Name: 2-[[3-[2-[bis(4-hydroxyphenyl)methylsulfanyl]ethyl]-2-methyl-1-benzofuran-7-yl]oxy]acetate Traditional Name: 2-[3-[2-[bis(4-hydroxyphenyl)methylthio]ethyl]-2-methyl-benzofuran-7-yl]oxyacetate Formula: C26H23O6S- MolecularWeight: 463.52222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C(=CC=C2)OCC(=O)[O-])CCSC(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C(C2=C(O1)C(=CC=C2)OCC(=O)[O-])CCSC(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C26H24O6S/c1-16-21(22-3-2-4-23(25(22)32-16)31-15-24(29)30)13-14-33-26(17-5-9-19(27)10-6-17)18-7-11-20(28)12-8-18/h2-12,26-28H,13-15H2,1H3,(H,29,30)/p-1