2-[(2S)-1-cyclopentyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[[3-(trifluoromethyl)phenyl]methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-[3-(trifluoromethyl)benzyl]piperazin-1-ium-2-yl]ethanol Formula: C19H28F3N2O+ MolecularWeight: 357.43363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2CCO)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(C[C@@H]2CCO)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H27F3N2O/c20-19(21,22)16-5-3-4-15(12-16)13-23-9-10-24(17-6-1-2-7-17)18(14-23)8-11-25/h3-5,12,17-18,25H,1-2,6-11,13-14H2/p+1/t18-/m0/s1