trimethyl (Z)-3-cyano-2-methylsulfanyl-prop-2-ene-1,1,3-tricarboxylate

Systemtic Name: trimethyl (Z)-3-cyano-2-methylsulfanyl-prop-2-ene-1,1,3-tricarboxylate Openeye Name: trimethyl (Z)-3-cyano-2-methylsulfanyl-prop-2-ene-1,1,3-tricarboxylate CAS Name: (Z)-3-cyano-2-(methylthio)-2-propene-1,1,3-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (Z)-3-cyano-2-methylsulfanylprop-2-ene-1,1,3-tricarboxylate Traditional Name: (Z)-3-cyano-2-(methylthio)prop-2-ene-1,1,3-tricarboxylic acid trimethyl ester Formula: C11H13NO6S MolecularWeight: 287.28902

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=C(C#N)C(=O)OC)SC)C(=O)OC

Isomeric SMILES

COC(=O)C(/C(=C(\C#N)/C(=O)OC)/SC)C(=O)OC

InChI

InChI=1S/C11H13NO6S/c1-16-9(13)6(5-12)8(19-4)7(10(14)17-2)11(15)18-3/h7H,1-4H3/b8-6-