(2S)-2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-ethanoyl-amino]propanoic acid

Systemtic Name: (2S)-2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-ethanoyl-amino]propanoic acid Openeye Name: (2S)-2-[acetyl-[(2-chloro-6-fluoro-phenyl)methyl]amino]propanoic acid CAS Name: (2S)-2-[acetyl-[(2-chloro-6-fluorophenyl)methyl]amino]propanoic acid IUPAC Name: (2S)-2-[acetyl-[(2-chloro-6-fluorophenyl)methyl]amino]propanoic acid Traditional Name: (2S)-2-[acetyl-(2-chloro-6-fluoro-benzyl)amino]propionic acid Formula: C12H13ClFNO3 MolecularWeight: 273.687923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(CC1=C(C=CC=C1Cl)F)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)O)N(CC1=C(C=CC=C1Cl)F)C(=O)C

InChI

InChI=1S/C12H13ClFNO3/c1-7(12(17)18)15(8(2)16)6-9-10(13)4-3-5-11(9)14/h3-5,7H,6H2,1-2H3,(H,17,18)/t7-/m0/s1