[(1S)-2-azaniumyl-1-[2,6-bis(fluoranyl)phenyl]ethyl]-dibutyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-[2,6-bis(fluoranyl)phenyl]ethyl]-dibutyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2,6-difluorophenyl)ethyl]-dibutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2,6-difluorophenyl)ethyl]-dibutylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2,6-difluorophenyl)ethyl]-dibutylazanium Traditional Name: [(1S)-2-ammonio-1-(2,6-difluorophenyl)ethyl]-dibutyl-ammonium Formula: C16H28F2N2+2 MolecularWeight: 286.403726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)C(C[NH3+])C1=C(C=CC=C1F)F

Isomeric SMILES

CCCC[NH+](CCCC)[C@H](C[NH3+])C1=C(C=CC=C1F)F

InChI

InChI=1S/C16H26F2N2/c1-3-5-10-20(11-6-4-2)15(12-19)16-13(17)8-7-9-14(16)18/h7-9,15H,3-6,10-12,19H2,1-2H3/p+2/t15-/m1/s1