diethyl 3-methyl-5-(2-pyridin-3-ylcarbonyloxypropanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(2-pyridin-3-ylcarbonyloxypropanoylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[2-(pyridine-3-carbonyloxy)propanoylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[oxo(3-pyridinyl)methoxy]propyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[2-(pyridine-3-carbonyloxy)propanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(2-nicotinoyloxypropanoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H22N2O7S MolecularWeight: 434.46288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C(C)OC(=O)C2=CN=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C(C)OC(=O)C2=CN=CC=C2

InChI

InChI=1S/C20H22N2O7S/c1-5-27-19(25)14-11(3)15(20(26)28-6-2)30-17(14)22-16(23)12(4)29-18(24)13-8-7-9-21-10-13/h7-10,12H,5-6H2,1-4H3,(H,22,23)