1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[[2,6-bis(fluoranyl)phenyl]methyl]-4-methyl-piperidin-1-ium Openeye Name: 1-[(2,6-difluorophenyl)methyl]-4-methyl-piperidin-1-ium CAS Name: 1-[(2,6-difluorophenyl)methyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[(2,6-difluorophenyl)methyl]-4-methylpiperidin-1-ium Traditional Name: 1-(2,6-difluorobenzyl)-4-methyl-piperidin-1-ium Formula: C13H18F2N+ MolecularWeight: 226.285526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(C=CC=C2F)F

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(C=CC=C2F)F

InChI

InChI=1S/C13H17F2N/c1-10-5-7-16(8-6-10)9-11-12(14)3-2-4-13(11)15/h2-4,10H,5-9H2,1H3/p+1