methyl 2-[2-(4-acetyloxy-3-methoxy-phenyl)-3-methylsulfanyl-1-benzofuran-5-yl]propanoate

Systemtic Name: methyl 2-[2-(4-acetyloxy-3-methoxy-phenyl)-3-methylsulfanyl-1-benzofuran-5-yl]propanoate Openeye Name: methyl 2-[2-(4-acetoxy-3-methoxy-phenyl)-3-methylsulfanyl-benzofuran-5-yl]propanoate CAS Name: 2-[2-(4-acetyloxy-3-methoxyphenyl)-3-(methylthio)-5-benzofuranyl]propanoic acid methyl ester IUPAC Name: methyl 2-[2-(4-acetyloxy-3-methoxyphenyl)-3-methylsulfanyl-1-benzofuran-5-yl]propanoate Traditional Name: 2-[2-(4-acetoxy-3-methoxy-phenyl)-3-(methylthio)benzofuran-5-yl]propionic acid methyl ester Formula: C22H22O6S MolecularWeight: 414.47148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OC(=C2SC)C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)OC

Isomeric SMILES

CC(C1=CC2=C(C=C1)OC(=C2SC)C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)OC

InChI

InChI=1S/C22H22O6S/c1-12(22(24)26-4)14-6-8-17-16(10-14)21(29-5)20(28-17)15-7-9-18(27-13(2)23)19(11-15)25-3/h6-12H,1-5H3