4-oxidanylidene-3-thiophen-2-yl-2-[2,2,2-tris(fluoranyl)ethanoyl]hexanoic acid

Systemtic Name: 4-oxidanylidene-3-thiophen-2-yl-2-[2,2,2-tris(fluoranyl)ethanoyl]hexanoic acid Openeye Name: 4-oxo-3-(2-thienyl)-2-(2,2,2-trifluoroacetyl)hexanoic acid CAS Name: 4-oxo-3-thiophen-2-yl-2-(2,2,2-trifluoro-1-oxoethyl)hexanoic acid IUPAC Name: 4-oxo-3-thiophen-2-yl-2-(2,2,2-trifluoroacetyl)hexanoic acid Traditional Name: 4-keto-3-(2-thienyl)-2-(2,2,2-trifluoroacetyl)hexanoic acid Formula: C12H11F3O4S MolecularWeight: 308.27355

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C1=CC=CS1)C(C(=O)C(F)(F)F)C(=O)O

Isomeric SMILES

CCC(=O)C(C1=CC=CS1)C(C(=O)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H11F3O4S/c1-2-6(16)8(7-4-3-5-20-7)9(11(18)19)10(17)12(13,14)15/h3-5,8-9H,2H2,1H3,(H,18,19)