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

Systemtic Name: (2S)-1-[[2,6-bis(fluoranyl)phenyl]methyl]-2-methyl-piperidin-1-ium Openeye Name: (2S)-1-[(2,6-difluorophenyl)methyl]-2-methyl-piperidin-1-ium CAS Name: (2S)-1-[(2,6-difluorophenyl)methyl]-2-methylpiperidin-1-ium IUPAC Name: (2S)-1-[(2,6-difluorophenyl)methyl]-2-methylpiperidin-1-ium Traditional Name: (2S)-1-(2,6-difluorobenzyl)-2-methyl-piperidin-1-ium Formula: C13H18F2N+ MolecularWeight: 226.285526

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(C=CC=C2F)F

Isomeric SMILES

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

InChI

InChI=1S/C13H17F2N/c1-10-5-2-3-8-16(10)9-11-12(14)6-4-7-13(11)15/h4,6-7,10H,2-3,5,8-9H2,1H3/p+1/t10-/m0/s1