methyl (E)-4-acetyloxy-3-(4-methylphenyl)sulfinyl-but-2-enoate

Systemtic Name: methyl (E)-4-acetyloxy-3-(4-methylphenyl)sulfinyl-but-2-enoate Openeye Name: methyl (E)-4-acetoxy-3-(p-tolylsulfinyl)but-2-enoate CAS Name: (E)-4-acetyloxy-3-(4-methylphenyl)sulfinyl-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-acetyloxy-3-(4-methylphenyl)sulfinylbut-2-enoate Traditional Name: (E)-4-acetoxy-3-(p-tolylsulfinyl)but-2-enoic acid methyl ester Formula: C14H16O5S MolecularWeight: 296.33884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(=CC(=O)OC)COC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)/C(=C/C(=O)OC)/COC(=O)C

InChI

InChI=1S/C14H16O5S/c1-10-4-6-12(7-5-10)20(17)13(8-14(16)18-3)9-19-11(2)15/h4-8H,9H2,1-3H3/b13-8+