(2S)-2-azaniumyl-3-[4-[bis(fluoranyl)-phosphonato-methyl]phenyl]propanoate

Systemtic Name: (2S)-2-azaniumyl-3-[4-[bis(fluoranyl)-phosphonato-methyl]phenyl]propanoate Openeye Name: (2S)-2-azaniumyl-3-[4-[difluoro(phosphonato)methyl]phenyl]propanoate CAS Name: (2S)-2-ammonio-3-[4-[difluoro(phosphonato)methyl]phenyl]propanoate IUPAC Name: (2S)-2-azaniumyl-3-[4-[difluoro(phosphonato)methyl]phenyl]propanoate Traditional Name: (2S)-2-ammonio-3-[4-[difluoro(phosphonato)methyl]phenyl]propionate Formula: C10H10F2NO5P-2 MolecularWeight: 293.160667

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)[O-])[NH3+])C(F)(F)P(=O)([O-])[O-]

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)[O-])[NH3+])C(F)(F)P(=O)([O-])[O-]

InChI

InChI=1S/C10H12F2NO5P/c11-10(12,19(16,17)18)7-3-1-6(2-4-7)5-8(13)9(14)15/h1-4,8H,5,13H2,(H,14,15)(H2,16,17,18)/p-2/t8-/m0/s1