(2S)-2-azanyl-3-[2,6-bis(fluoranyl)-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[2,6-bis(fluoranyl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: (2S)-2-amino-3-(2,6-difluoro-4-hydroxy-phenyl)propanoic acid CAS Name: (2S)-2-amino-3-(2,6-difluoro-4-hydroxyphenyl)propanoic acid IUPAC Name: (2S)-2-amino-3-(2,6-difluoro-4-hydroxyphenyl)propanoic acid Traditional Name: (2S)-2-amino-3-(2,6-difluoro-4-hydroxy-phenyl)propionic acid Formula: C9H9F2NO3 MolecularWeight: 217.169466

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1F)CC(C(=O)O)N)F)O

Isomeric SMILES

C1=C(C=C(C(=C1F)C[C@@H](C(=O)O)N)F)O

InChI

InChI=1S/C9H9F2NO3/c10-6-1-4(13)2-7(11)5(6)3-8(12)9(14)15/h1-2,8,13H,3,12H2,(H,14,15)/t8-/m0/s1