(2R,3S)-2-azaniumyl-4,4,4-tris(fluoranyl)-3-phenyl-butanoate

Systemtic Name: (2R,3S)-2-azaniumyl-4,4,4-tris(fluoranyl)-3-phenyl-butanoate Openeye Name: (2R,3S)-2-azaniumyl-4,4,4-trifluoro-3-phenyl-butanoate CAS Name: (2R,3S)-2-ammonio-4,4,4-trifluoro-3-phenylbutanoate IUPAC Name: (2R,3S)-2-azaniumyl-4,4,4-trifluoro-3-phenylbutanoate Traditional Name: (2R,3S)-2-ammonio-4,4,4-trifluoro-3-phenyl-butyrate Formula: C10H10F3NO2 MolecularWeight: 233.18711

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10F3NO2/c11-10(12,13)7(8(14)9(15)16)6-4-2-1-3-5-6/h1-5,7-8H,14H2,(H,15,16)/t7-,8+/m0/s1