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

Systemtic Name: (1S)-1-[2,6-bis(fluoranyl)phenyl]-2-piperidin-1-ium-1-yl-ethanamine Openeye Name: (1S)-1-(2,6-difluorophenyl)-2-piperidin-1-ium-1-yl-ethanamine CAS Name: (1S)-1-(2,6-difluorophenyl)-2-(1-piperidin-1-iumyl)ethanamine IUPAC Name: (1S)-1-(2,6-difluorophenyl)-2-piperidin-1-ium-1-ylethanamine Traditional Name: [(1S)-1-(2,6-difluorophenyl)-2-piperidin-1-ium-1-yl-ethyl]amine Formula: C13H19F2N2+ MolecularWeight: 241.300166

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C2=C(C=CC=C2F)F)N

Isomeric SMILES

C1CC[NH+](CC1)C[C@H](C2=C(C=CC=C2F)F)N

InChI

InChI=1S/C13H18F2N2/c14-10-5-4-6-11(15)13(10)12(16)9-17-7-2-1-3-8-17/h4-6,12H,1-3,7-9,16H2/p+1/t12-/m1/s1