methyl 2-[[3-(3,3-diphenylpropylsulfanylmethyl)-1-benzofuran-7-yl]oxy]ethanoate

Systemtic Name: methyl 2-[[3-(3,3-diphenylpropylsulfanylmethyl)-1-benzofuran-7-yl]oxy]ethanoate Openeye Name: methyl 2-[3-(3,3-diphenylpropylsulfanylmethyl)benzofuran-7-yl]oxyacetate CAS Name: 2-[[3-[(3,3-diphenylpropylthio)methyl]-7-benzofuranyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(3,3-diphenylpropylsulfanylmethyl)-1-benzofuran-7-yl]oxy]acetate Traditional Name: 2-[3-[(3,3-diphenylpropylthio)methyl]benzofuran-7-yl]oxyacetic acid methyl ester Formula: C27H26O4S MolecularWeight: 446.55794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC2=C1OC=C2CSCCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)COC1=CC=CC2=C1OC=C2CSCCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26O4S/c1-29-26(28)18-30-25-14-8-13-24-22(17-31-27(24)25)19-32-16-15-23(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-14,17,23H,15-16,18-19H2,1H3