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

Systemtic Name: 2-[3-[3,4-bis(fluoranyl)phenyl]propanoylamino]hexanoic acid Openeye Name: 2-[3-(3,4-difluorophenyl)propanoylamino]hexanoic acid CAS Name: 2-[[3-(3,4-difluorophenyl)-1-oxopropyl]amino]hexanoic acid IUPAC Name: 2-[3-(3,4-difluorophenyl)propanoylamino]hexanoic acid Traditional Name: 2-[3-(3,4-difluorophenyl)propanoylamino]hexanoic acid Formula: C15H19F2NO3 MolecularWeight: 299.313066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19F2NO3/c1-2-3-4-13(15(20)21)18-14(19)8-6-10-5-7-11(16)12(17)9-10/h5,7,9,13H,2-4,6,8H2,1H3,(H,18,19)(H,20,21)