(3S)-1-[[2,4-bis(fluoranyl)phenyl]methyl]piperidin-1-ium-3-ol

Systemtic Name: (3S)-1-[[2,4-bis(fluoranyl)phenyl]methyl]piperidin-1-ium-3-ol Openeye Name: (3S)-1-[(2,4-difluorophenyl)methyl]piperidin-1-ium-3-ol CAS Name: (3S)-1-[(2,4-difluorophenyl)methyl]-3-piperidin-1-iumol IUPAC Name: (3S)-1-[(2,4-difluorophenyl)methyl]piperidin-1-ium-3-ol Traditional Name: (3S)-1-(2,4-difluorobenzyl)piperidin-1-ium-3-ol Formula: C12H16F2NO+ MolecularWeight: 228.258346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=C(C=C(C=C2)F)F)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=C(C=C(C=C2)F)F)O

InChI

InChI=1S/C12H15F2NO/c13-10-4-3-9(12(14)6-10)7-15-5-1-2-11(16)8-15/h3-4,6,11,16H,1-2,5,7-8H2/p+1/t11-/m0/s1