3-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[2-(difluoromethylsulfanyl)benzoyl]amino]propanoic acid CAS Name: 3-[[[2-(difluoromethylthio)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[2-(difluoromethylsulfanyl)benzoyl]amino]propanoic acid Traditional Name: 3-[[2-(difluoromethylthio)benzoyl]amino]propionic acid Formula: C11H11F2NO3S MolecularWeight: 275.271746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCC(=O)O)SC(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCC(=O)O)SC(F)F

InChI

InChI=1S/C11H11F2NO3S/c12-11(13)18-8-4-2-1-3-7(8)10(17)14-6-5-9(15)16/h1-4,11H,5-6H2,(H,14,17)(H,15,16)