diethyl 2-(3-oxidanylidene-1-phenyl-3-thiophen-2-yl-propyl)propanedioate

Systemtic Name: diethyl 2-(3-oxidanylidene-1-phenyl-3-thiophen-2-yl-propyl)propanedioate Openeye Name: diethyl 2-[3-oxo-1-phenyl-3-(2-thienyl)propyl]propanedioate CAS Name: 2-(3-oxo-1-phenyl-3-thiophen-2-ylpropyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-oxo-1-phenyl-3-thiophen-2-ylpropyl)propanedioate Traditional Name: 2-[3-keto-1-phenyl-3-(2-thienyl)propyl]malonic acid diethyl ester Formula: C20H22O5S MolecularWeight: 374.45068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC(=O)C1=CC=CS1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(CC(=O)C1=CC=CS1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C20H22O5S/c1-3-24-19(22)18(20(23)25-4-2)15(14-9-6-5-7-10-14)13-16(21)17-11-8-12-26-17/h5-12,15,18H,3-4,13H2,1-2H3