dimethyl 4-(2-ethanoylsulfanylethyl)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 4-(2-ethanoylsulfanylethyl)benzene-1,3-dicarboxylate Openeye Name: dimethyl 4-(2-acetylsulfanylethyl)benzene-1,3-dicarboxylate CAS Name: 4-[2-(acetylthio)ethyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(2-acetylsulfanylethyl)benzene-1,3-dicarboxylate Traditional Name: 4-[2-(acetylthio)ethyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C14H16O5S MolecularWeight: 296.33884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC1=C(C=C(C=C1)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)SCCC1=C(C=C(C=C1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C14H16O5S/c1-9(15)20-7-6-10-4-5-11(13(16)18-2)8-12(10)14(17)19-3/h4-5,8H,6-7H2,1-3H3