(2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-methyl-3-(propanoylamino)benzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-methyl-3-(propanoylamino)benzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 4-methyl-3-(propanoylamino)benzoate CAS Name: 4-methyl-3-(1-oxopropylamino)benzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 4-methyl-3-(propanoylamino)benzoate Traditional Name: 4-methyl-3-propionamido-benzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO4S/c1-3-16(20)18-13-9-12(7-6-11(13)2)17(21)22-10-14(19)15-5-4-8-23-15/h4-9H,3,10H2,1-2H3,(H,18,20)