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

Systemtic Name: 2-[(2S)-1-[(2-fluorophenyl)methyl]-4-propan-2-yl-piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-[(2-fluorophenyl)methyl]-4-isopropyl-piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-[(2-fluorophenyl)methyl]-4-propan-2-yl-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-[(2-fluorophenyl)methyl]-4-propan-2-ylpiperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-(2-fluorobenzyl)-4-isopropyl-piperazin-4-ium-2-yl]ethanol Formula: C16H26FN2O+ MolecularWeight: 281.388843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(C(C1)CCO)CC2=CC=CC=C2F

Isomeric SMILES

CC(C)[NH+]1CCN([C@H](C1)CCO)CC2=CC=CC=C2F

InChI

InChI=1S/C16H25FN2O/c1-13(2)18-8-9-19(15(12-18)7-10-20)11-14-5-3-4-6-16(14)17/h3-6,13,15,20H,7-12H2,1-2H3/p+1/t15-/m0/s1