(2S)-2-azaniumyl-3,3-bis(fluoranyl)-3-(4-fluorophenyl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3,3-bis(fluoranyl)-3-(4-fluorophenyl)propanoate Openeye Name: (2S)-2-azaniumyl-3,3-difluoro-3-(4-fluorophenyl)propanoate CAS Name: (2S)-2-ammonio-3,3-difluoro-3-(4-fluorophenyl)propanoate IUPAC Name: (2S)-2-azaniumyl-3,3-difluoro-3-(4-fluorophenyl)propanoate Traditional Name: (2S)-2-ammonio-3,3-difluoro-3-(4-fluorophenyl)propionate Formula: C9H8F3NO2 MolecularWeight: 219.16053

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8F3NO2/c10-6-3-1-5(2-4-6)9(11,12)7(13)8(14)15/h1-4,7H,13H2,(H,14,15)/t7-/m0/s1