diethyl 2-(2-thiophen-2-ylethyl)propanedioate

Systemtic Name: diethyl 2-(2-thiophen-2-ylethyl)propanedioate Openeye Name: diethyl 2-[2-(2-thienyl)ethyl]propanedioate CAS Name: 2-(2-thiophen-2-ylethyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-thiophen-2-ylethyl)propanedioate Traditional Name: 2-[2-(2-thienyl)ethyl]malonic acid diethyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CS1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CS1)C(=O)OCC

InChI

InChI=1S/C13H18O4S/c1-3-16-12(14)11(13(15)17-4-2)8-7-10-6-5-9-18-10/h5-6,9,11H,3-4,7-8H2,1-2H3