3-oxidanyl-2-[[4-(trifluoromethylsulfanyl)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-oxidanyl-2-[[4-(trifluoromethylsulfanyl)phenyl]carbonylamino]propanoic acid Openeye Name: 3-hydroxy-2-[[4-(trifluoromethylsulfanyl)benzoyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[oxo-[4-(trifluoromethylthio)phenyl]methyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[4-(trifluoromethylsulfanyl)benzoyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[4-(trifluoromethylthio)benzoyl]amino]propionic acid Formula: C11H10F3NO4S MolecularWeight: 309.26161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CO)C(=O)O)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CO)C(=O)O)SC(F)(F)F

InChI

InChI=1S/C11H10F3NO4S/c12-11(13,14)20-7-3-1-6(2-4-7)9(17)15-8(5-16)10(18)19/h1-4,8,16H,5H2,(H,15,17)(H,18,19)