2-[(2S)-4-[(2-fluorophenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(2-fluorophenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(2-fluorophenyl)methyl]-1-isobutyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(2-fluorophenyl)methyl]-1-(2-methylpropyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(2-fluorophenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(2-fluorobenzyl)-1-isobutyl-piperazin-1-ium-2-yl]ethanol Formula: C17H28FN2O+ MolecularWeight: 295.415423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCN(CC1CCO)CC2=CC=CC=C2F

Isomeric SMILES

CC(C)C[NH+]1CCN(C[C@@H]1CCO)CC2=CC=CC=C2F

InChI

InChI=1S/C17H27FN2O/c1-14(2)11-20-9-8-19(13-16(20)7-10-21)12-15-5-3-4-6-17(15)18/h3-6,14,16,21H,7-13H2,1-2H3/p+1/t16-/m0/s1