(2S)-2-azaniumyl-3-(2-fluoranyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(2-fluoranyl-4-oxidanyl-phenyl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(2-fluoro-4-hydroxy-phenyl)propanoate CAS Name: (2S)-2-ammonio-3-(2-fluoro-4-hydroxyphenyl)propanoate IUPAC Name: (2S)-2-azaniumyl-3-(2-fluoro-4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-ammonio-3-(2-fluoro-4-hydroxy-phenyl)propionate Formula: C9H10FNO3 MolecularWeight: 199.179003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)F)CC(C(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC(=C(C=C1O)F)C[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C9H10FNO3/c10-7-4-6(12)2-1-5(7)3-8(11)9(13)14/h1-2,4,8,12H,3,11H2,(H,13,14)/t8-/m0/s1