3-[[2,4-bis(fluoranyl)phenyl]-propanoyl-amino]propanoic acid

Systemtic Name: 3-[[2,4-bis(fluoranyl)phenyl]-propanoyl-amino]propanoic acid Openeye Name: 3-(2,4-difluoro-N-propanoyl-anilino)propanoic acid CAS Name: 3-[2,4-difluoro-N-(1-oxopropyl)anilino]propanoic acid IUPAC Name: 3-(2,4-difluoro-N-propanoylanilino)propanoic acid Traditional Name: 3-(2,4-difluoro-N-propionyl-anilino)propionic acid Formula: C12H13F2NO3 MolecularWeight: 257.233326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CCC(=O)O)C1=C(C=C(C=C1)F)F

Isomeric SMILES

CCC(=O)N(CCC(=O)O)C1=C(C=C(C=C1)F)F

InChI

InChI=1S/C12H13F2NO3/c1-2-11(16)15(6-5-12(17)18)10-4-3-8(13)7-9(10)14/h3-4,7H,2,5-6H2,1H3,(H,17,18)