(2S)-1-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxy-propan-2-ol Openeye Name: (2S)-1-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-3-isopropoxy-propan-2-ol CAS Name: (2S)-1-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-3-propan-2-yloxy-2-propanol IUPAC Name: (2S)-1-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxypropan-2-ol Traditional Name: (2S)-1-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-3-isopropoxy-propan-2-ol Formula: C16H26FN2O2+ MolecularWeight: 297.388243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(C[NH+]1CCN(CC1)C2=CC=C(C=C2)F)O

Isomeric SMILES

CC(C)OC[C@H](C[NH+]1CCN(CC1)C2=CC=C(C=C2)F)O

InChI

InChI=1S/C16H25FN2O2/c1-13(2)21-12-16(20)11-18-7-9-19(10-8-18)15-5-3-14(17)4-6-15/h3-6,13,16,20H,7-12H2,1-2H3/p+1/t16-/m0/s1