2-azanyl-3-[4-[1,1-bis(fluoranyl)-2-oxidanyl-2-oxidanylidene-ethyl]phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[1,1-bis(fluoranyl)-2-oxidanyl-2-oxidanylidene-ethyl]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(1,1-difluoro-2-hydroxy-2-oxo-ethyl)phenyl]propanoic acid CAS Name: 2-amino-3-[4-(1,1-difluoro-2-hydroxy-2-oxoethyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(1,1-difluoro-2-hydroxy-2-oxoethyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[4-(1,1-difluoro-2-hydroxy-2-keto-ethyl)phenyl]propionic acid Formula: C11H11F2NO4 MolecularWeight: 259.206146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11F2NO4/c12-11(13,10(17)18)7-3-1-6(2-4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)(H,17,18)