[(1S)-1-[3,4-bis(fluoranyl)phenyl]ethyl]-cyclooctyl-azanium

Systemtic Name: [(1S)-1-[3,4-bis(fluoranyl)phenyl]ethyl]-cyclooctyl-azanium Openeye Name: cyclooctyl-[(1S)-1-(3,4-difluorophenyl)ethyl]ammonium CAS Name: cyclooctyl-[(1S)-1-(3,4-difluorophenyl)ethyl]ammonium IUPAC Name: cyclooctyl-[(1S)-1-(3,4-difluorophenyl)ethyl]azanium Traditional Name: cyclooctyl-[(1S)-1-(3,4-difluorophenyl)ethyl]ammonium Formula: C16H24F2N+ MolecularWeight: 268.365266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)F)[NH2+]C2CCCCCCC2

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)F)F)[NH2+]C2CCCCCCC2

InChI

InChI=1S/C16H23F2N/c1-12(13-9-10-15(17)16(18)11-13)19-14-7-5-3-2-4-6-8-14/h9-12,14,19H,2-8H2,1H3/p+1/t12-/m0/s1