(2-oxidanylidene-2-thiophen-2-yl-ethyl) 3-(4-acetamidophenyl)sulfonylpropanoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 3-(4-acetamidophenyl)sulfonylpropanoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 3-(4-acetamidophenyl)sulfonylpropanoate CAS Name: 3-(4-acetamidophenyl)sulfonylpropanoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 3-(4-acetamidophenyl)sulfonylpropanoate Traditional Name: 3-(4-acetamidophenyl)sulfonylpropionic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C17H17NO6S2 MolecularWeight: 395.44998

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC(=O)C2=CC=CS2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC(=O)C2=CC=CS2

InChI

InChI=1S/C17H17NO6S2/c1-12(19)18-13-4-6-14(7-5-13)26(22,23)10-8-17(21)24-11-15(20)16-3-2-9-25-16/h2-7,9H,8,10-11H2,1H3,(H,18,19)