4-oxidanylidene-4-[[2-(trifluoromethylsulfanyl)phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[2-(trifluoromethylsulfanyl)phenyl]amino]butanoic acid Openeye Name: 4-oxo-4-[2-(trifluoromethylsulfanyl)anilino]butanoic acid CAS Name: 4-oxo-4-[2-(trifluoromethylthio)anilino]butanoic acid IUPAC Name: 4-oxo-4-[2-(trifluoromethylsulfanyl)anilino]butanoic acid Traditional Name: 4-keto-4-[2-(trifluoromethylthio)anilino]butyric acid Formula: C11H10F3NO3S MolecularWeight: 293.26221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCC(=O)O)SC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCC(=O)O)SC(F)(F)F

InChI

InChI=1S/C11H10F3NO3S/c12-11(13,14)19-8-4-2-1-3-7(8)15-9(16)5-6-10(17)18/h1-4H,5-6H2,(H,15,16)(H,17,18)