(E)-4-(2-ethanoylsulfanylethoxy)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(2-ethanoylsulfanylethoxy)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(2-acetylsulfanylethoxy)-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-(acetylthio)ethoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(2-acetylsulfanylethoxy)-4-oxobut-2-enoic acid Traditional Name: (E)-4-[2-(acetylthio)ethoxy]-4-keto-but-2-enoic acid Formula: C8H10O5S MolecularWeight: 218.227

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCOC(=O)C=CC(=O)O

Isomeric SMILES

CC(=O)SCCOC(=O)/C=C/C(=O)O

InChI

InChI=1S/C8H10O5S/c1-6(9)14-5-4-13-8(12)3-2-7(10)11/h2-3H,4-5H2,1H3,(H,10,11)/b3-2+