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

Systemtic Name: 2-[3-[3,4-bis(fluoranyl)phenyl]propanoylamino]propanoic acid Openeye Name: 2-[3-(3,4-difluorophenyl)propanoylamino]propanoic acid CAS Name: 2-[[3-(3,4-difluorophenyl)-1-oxopropyl]amino]propanoic acid IUPAC Name: 2-[3-(3,4-difluorophenyl)propanoylamino]propanoic acid Traditional Name: 2-[3-(3,4-difluorophenyl)propanoylamino]propionic acid Formula: C12H13F2NO3 MolecularWeight: 257.233326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CCC1=CC(=C(C=C1)F)F

Isomeric SMILES

CC(C(=O)O)NC(=O)CCC1=CC(=C(C=C1)F)F

InChI

InChI=1S/C12H13F2NO3/c1-7(12(17)18)15-11(16)5-3-8-2-4-9(13)10(14)6-8/h2,4,6-7H,3,5H2,1H3,(H,15,16)(H,17,18)