diethyl (E)-2-pent-4-ynylsulfanylbut-2-enedioate

Systemtic Name: diethyl (E)-2-pent-4-ynylsulfanylbut-2-enedioate Openeye Name: diethyl (E)-2-pent-4-ynylsulfanylbut-2-enedioate CAS Name: (E)-2-(pent-4-ynylthio)-2-butenedioic acid diethyl ester IUPAC Name: diethyl (E)-2-pent-4-ynylsulfanylbut-2-enedioate Traditional Name: (E)-2-(pent-4-ynylthio)but-2-enedioic acid diethyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C(=O)OCC)SCCCC#C

Isomeric SMILES

CCOC(=O)/C=C(\C(=O)OCC)/SCCCC#C

InChI

InChI=1S/C13H18O4S/c1-4-7-8-9-18-11(13(15)17-6-3)10-12(14)16-5-2/h1,10H,5-9H2,2-3H3/b11-10+