O1-(3-ethanoylsulfanylpropyl) O4-prop-2-enyl (E)-but-2-enedioate

Systemtic Name: O1-(3-ethanoylsulfanylpropyl) O4-prop-2-enyl (E)-but-2-enedioate Openeye Name: O1-(3-acetylsulfanylpropyl) O4-allyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-[3-(acetylthio)propyl] ester O4-prop-2-enyl ester IUPAC Name: 1-O-(3-acetylsulfanylpropyl) 4-O-prop-2-enyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-[3-(acetylthio)propyl] ester O4-allyl ester Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCOC(=O)C=CC(=O)OCC=C

Isomeric SMILES

CC(=O)SCCCOC(=O)/C=C/C(=O)OCC=C

InChI

InChI=1S/C12H16O5S/c1-3-7-16-11(14)5-6-12(15)17-8-4-9-18-10(2)13/h3,5-6H,1,4,7-9H2,2H3/b6-5+