methyl 2-[2-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1-benzofuran-5-yl]ethanoate

Systemtic Name: methyl 2-[2-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1-benzofuran-5-yl]ethanoate Openeye Name: methyl 2-[2-(3,4-dimethoxyphenyl)-3-methylsulfanyl-benzofuran-5-yl]acetate CAS Name: 2-[2-(3,4-dimethoxyphenyl)-3-(methylthio)-5-benzofuranyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1-benzofuran-5-yl]acetate Traditional Name: 2-[2-(3,4-dimethoxyphenyl)-3-(methylthio)benzofuran-5-yl]acetic acid methyl ester Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C3=C(O2)C=CC(=C3)CC(=O)OC)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=C(O2)C=CC(=C3)CC(=O)OC)SC)OC

InChI

InChI=1S/C20H20O5S/c1-22-16-8-6-13(11-17(16)23-2)19-20(26-4)14-9-12(10-18(21)24-3)5-7-15(14)25-19/h5-9,11H,10H2,1-4H3