(2S)-1-[[2,6-bis(fluoranyl)phenyl]methyl]-2-ethyl-piperidin-1-ium

Systemtic Name: (2S)-1-[[2,6-bis(fluoranyl)phenyl]methyl]-2-ethyl-piperidin-1-ium Openeye Name: (2S)-1-[(2,6-difluorophenyl)methyl]-2-ethyl-piperidin-1-ium CAS Name: (2S)-1-[(2,6-difluorophenyl)methyl]-2-ethylpiperidin-1-ium IUPAC Name: (2S)-1-[(2,6-difluorophenyl)methyl]-2-ethylpiperidin-1-ium Traditional Name: (2S)-1-(2,6-difluorobenzyl)-2-ethyl-piperidin-1-ium Formula: C14H20F2N+ MolecularWeight: 240.312106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C(C=CC=C2F)F

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=C(C=CC=C2F)F

InChI

InChI=1S/C14H19F2N/c1-2-11-6-3-4-9-17(11)10-12-13(15)7-5-8-14(12)16/h5,7-8,11H,2-4,6,9-10H2,1H3/p+1/t11-/m0/s1