[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C12H12F3NO4S MolecularWeight: 323.28819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)CCC(=O)OCC(=O)NCC(F)(F)F

Isomeric SMILES

C1=CSC(=C1)C(=O)CCC(=O)OCC(=O)NCC(F)(F)F

InChI

InChI=1S/C12H12F3NO4S/c13-12(14,15)7-16-10(18)6-20-11(19)4-3-8(17)9-2-1-5-21-9/h1-2,5H,3-4,6-7H2,(H,16,18)