diethyl 2-pyridin-3-ylcarbonyl-2-thiophen-2-yl-propanedioate

Systemtic Name: diethyl 2-pyridin-3-ylcarbonyl-2-thiophen-2-yl-propanedioate Openeye Name: diethyl 2-(pyridine-3-carbonyl)-2-(2-thienyl)propanedioate CAS Name: 2-[oxo(3-pyridinyl)methyl]-2-thiophen-2-ylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-(pyridine-3-carbonyl)-2-thiophen-2-ylpropanedioate Traditional Name: 2-nicotinoyl-2-(2-thienyl)malonic acid diethyl ester Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO5S/c1-3-22-15(20)17(16(21)23-4-2,13-8-6-10-24-13)14(19)12-7-5-9-18-11-12/h5-11H,3-4H2,1-2H3