(2R)-2-azaniumyl-2-[3,5-bis(fluoranyl)phenyl]ethanoate

Systemtic Name: (2R)-2-azaniumyl-2-[3,5-bis(fluoranyl)phenyl]ethanoate Openeye Name: (2R)-2-azaniumyl-2-(3,5-difluorophenyl)acetate CAS Name: (2R)-2-ammonio-2-(3,5-difluorophenyl)acetate IUPAC Name: (2R)-2-azaniumyl-2-(3,5-difluorophenyl)acetate Traditional Name: (2R)-2-ammonio-2-(3,5-difluorophenyl)acetate Formula: C8H7F2NO2 MolecularWeight: 187.143486

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)C(C(=O)[O-])[NH3+]

Isomeric SMILES

C1=C(C=C(C=C1F)F)[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C8H7F2NO2/c9-5-1-4(2-6(10)3-5)7(11)8(12)13/h1-3,7H,11H2,(H,12,13)/t7-/m1/s1