dimethyl (Z)-2-(3-methylsulfanylpropanoyl)but-2-enedioate

Systemtic Name: dimethyl (Z)-2-(3-methylsulfanylpropanoyl)but-2-enedioate Openeye Name: dimethyl (Z)-2-(3-methylsulfanylpropanoyl)but-2-enedioate CAS Name: (Z)-2-[3-(methylthio)-1-oxopropyl]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (Z)-2-(3-methylsulfanylpropanoyl)but-2-enedioate Traditional Name: (Z)-2-[3-(methylthio)propanoyl]but-2-enedioic acid dimethyl ester Formula: C10H14O5S MolecularWeight: 246.28016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)CCSC)C(=O)OC

Isomeric SMILES

COC(=O)/C=C(/C(=O)CCSC)\C(=O)OC

InChI

InChI=1S/C10H14O5S/c1-14-9(12)6-7(10(13)15-2)8(11)4-5-16-3/h6H,4-5H2,1-3H3/b7-6-