2-azanyl-3-[4-[bis(fluoranyl)methylsulfanyl]phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[bis(fluoranyl)methylsulfanyl]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(difluoromethylsulfanyl)phenyl]propanoic acid CAS Name: 2-amino-3-[4-(difluoromethylthio)phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(difluoromethylsulfanyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[4-(difluoromethylthio)phenyl]propionic acid Formula: C10H11F2NO2S MolecularWeight: 247.261646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)SC(F)F

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)SC(F)F

InChI

InChI=1S/C10H11F2NO2S/c11-10(12)16-7-3-1-6(2-4-7)5-8(13)9(14)15/h1-4,8,10H,5,13H2,(H,14,15)