2-[(2S)-1-cyclopentyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[[2-(trifluoromethyl)phenyl]methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-[2-(trifluoromethyl)benzyl]piperazin-1-ium-2-yl]ethanol Formula: C19H28F3N2O+ MolecularWeight: 357.43363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2CCO)CC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(C[C@@H]2CCO)CC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H27F3N2O/c20-19(21,22)18-8-4-1-5-15(18)13-23-10-11-24(16-6-2-3-7-16)17(14-23)9-12-25/h1,4-5,8,16-17,25H,2-3,6-7,9-14H2/p+1/t17-/m0/s1