2-[[2-(2-acetyloxypropyl)-3-[2-(diphenylmethyl)sulfanylethyl]-1-benzofuran-7-yl]oxy]ethanoate

Systemtic Name: 2-[[2-(2-acetyloxypropyl)-3-[2-(diphenylmethyl)sulfanylethyl]-1-benzofuran-7-yl]oxy]ethanoate Openeye Name: 2-[2-(2-acetoxypropyl)-3-(2-benzhydrylsulfanylethyl)benzofuran-7-yl]oxyacetate CAS Name: 2-[[2-(2-acetyloxypropyl)-3-[2-[(diphenylmethyl)thio]ethyl]-7-benzofuranyl]oxy]acetate IUPAC Name: 2-[[2-(2-acetyloxypropyl)-3-(2-benzhydrylsulfanylethyl)-1-benzofuran-7-yl]oxy]acetate Traditional Name: 2-[2-(2-acetoxypropyl)-3-[2-(benzhydrylthio)ethyl]benzofuran-7-yl]oxyacetate Formula: C30H29O6S- MolecularWeight: 517.61266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H30O6S/c1-20(35-21(2)31)18-27-24(25-14-9-15-26(29(25)36-27)34-19-28(32)33)16-17-37-30(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-15,20,30H,16-19H2,1-2H3,(H,32,33)/p-1