diethyl 2-(3-oxidanylidene-1-thiophen-2-yl-butyl)propanedioate

Systemtic Name: diethyl 2-(3-oxidanylidene-1-thiophen-2-yl-butyl)propanedioate Openeye Name: diethyl 2-[3-oxo-1-(2-thienyl)butyl]propanedioate CAS Name: 2-(3-oxo-1-thiophen-2-ylbutyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-oxo-1-thiophen-2-ylbutyl)propanedioate Traditional Name: 2-[3-keto-1-(2-thienyl)butyl]malonic acid diethyl ester Formula: C15H20O5S MolecularWeight: 312.3813

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC(=O)C)C1=CC=CS1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(CC(=O)C)C1=CC=CS1)C(=O)OCC

InChI

InChI=1S/C15H20O5S/c1-4-19-14(17)13(15(18)20-5-2)11(9-10(3)16)12-7-6-8-21-12/h6-8,11,13H,4-5,9H2,1-3H3