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

Systemtic Name: 2-[[2-(2-acetyloxyethyl)-3-[2-(diphenylmethyl)sulfanylethyl]-1-benzofuran-7-yl]oxy]ethanoate Openeye Name: 2-[2-(2-acetoxyethyl)-3-(2-benzhydrylsulfanylethyl)benzofuran-7-yl]oxyacetate CAS Name: 2-[[2-(2-acetyloxyethyl)-3-[2-[(diphenylmethyl)thio]ethyl]-7-benzofuranyl]oxy]acetate IUPAC Name: 2-[[2-(2-acetyloxyethyl)-3-(2-benzhydrylsulfanylethyl)-1-benzofuran-7-yl]oxy]acetate Traditional Name: 2-[2-(2-acetoxyethyl)-3-[2-(benzhydrylthio)ethyl]benzofuran-7-yl]oxyacetate Formula: C29H27O6S- MolecularWeight: 503.58608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=C(C2=C(O1)C(=CC=C2)OCC(=O)[O-])CCSC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OCCC1=C(C2=C(O1)C(=CC=C2)OCC(=O)[O-])CCSC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H28O6S/c1-20(30)33-17-15-25-23(24-13-8-14-26(28(24)35-25)34-19-27(31)32)16-18-36-29(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-14,29H,15-19H2,1H3,(H,31,32)/p-1