(1S)-1-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-ethanol

Systemtic Name: (1S)-1-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-ethanol Openeye Name: (1S)-1-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-ethanol CAS Name: (1S)-1-(4-fluorophenyl)-2-(1-piperazin-4-iumyl)ethanol IUPAC Name: (1S)-1-(4-fluorophenyl)-2-piperazin-4-ium-1-ylethanol Traditional Name: (1S)-1-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-ethanol Formula: C12H18FN2O+ MolecularWeight: 225.282523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC(C2=CC=C(C=C2)F)O

Isomeric SMILES

C1CN(CC[NH2+]1)C[C@H](C2=CC=C(C=C2)F)O

InChI

InChI=1S/C12H17FN2O/c13-11-3-1-10(2-4-11)12(16)9-15-7-5-14-6-8-15/h1-4,12,14,16H,5-9H2/p+1/t12-/m1/s1