6-[3-[3,4-bis(fluoranyl)phenyl]propanoylamino]hexanoic acid

Systemtic Name: 6-[3-[3,4-bis(fluoranyl)phenyl]propanoylamino]hexanoic acid Openeye Name: 6-[3-(3,4-difluorophenyl)propanoylamino]hexanoic acid CAS Name: 6-[[3-(3,4-difluorophenyl)-1-oxopropyl]amino]hexanoic acid IUPAC Name: 6-[3-(3,4-difluorophenyl)propanoylamino]hexanoic acid Traditional Name: 6-[3-(3,4-difluorophenyl)propanoylamino]hexanoic acid Formula: C15H19F2NO3 MolecularWeight: 299.313066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC(=O)NCCCCCC(=O)O)F)F

Isomeric SMILES

C1=CC(=C(C=C1CCC(=O)NCCCCCC(=O)O)F)F

InChI

InChI=1S/C15H19F2NO3/c16-12-7-5-11(10-13(12)17)6-8-14(19)18-9-3-1-2-4-15(20)21/h5,7,10H,1-4,6,8-9H2,(H,18,19)(H,20,21)