2-[[3-[3-(1,1-diphenylethylsulfanyl)butyl]-2,3-dihydro-1-benzofuran-7-yl]oxy]ethanoate

Systemtic Name: 2-[[3-[3-(1,1-diphenylethylsulfanyl)butyl]-2,3-dihydro-1-benzofuran-7-yl]oxy]ethanoate Openeye Name: 2-[[3-[3-(1,1-diphenylethylsulfanyl)butyl]-2,3-dihydrobenzofuran-7-yl]oxy]acetate CAS Name: 2-[[3-[3-(1,1-diphenylethylthio)butyl]-2,3-dihydrobenzofuran-7-yl]oxy]acetate IUPAC Name: 2-[[3-[3-(1,1-diphenylethylsulfanyl)butyl]-2,3-dihydro-1-benzofuran-7-yl]oxy]acetate Traditional Name: 2-[3-[3-(1,1-diphenylethylthio)butyl]coumaran-7-yl]oxyacetate Formula: C28H29O4S- MolecularWeight: 461.59246

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1COC2=C1C=CC=C2OCC(=O)[O-])SC(C)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CCC1COC2=C1C=CC=C2OCC(=O)[O-])SC(C)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H30O4S/c1-20(33-28(2,22-10-5-3-6-11-22)23-12-7-4-8-13-23)16-17-21-18-32-27-24(21)14-9-15-25(27)31-19-26(29)30/h3-15,20-21H,16-19H2,1-2H3,(H,29,30)/p-1