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2-[(2S)-1-cyclopentyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol
2-[(2S)-1-cyclopentyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanol
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Descriptors Computed from Structure
Canonical SMILES:
C1CCC(C1)[NH+]2CCN(CC2CCO)CC3=CC=C(C=C3)C(F)(F)F
Isomeric SMILES
C1CCC(C1)[NH+]2CCN(C[C@@H]2CCO)CC3=CC=C(C=C3)C(F)(F)F
InChI
InChI=1S/C19H27F3N2O/c20-19(21,22)16-7-5-15(6-8-16)13-23-10-11-24(17-3-1-2-4-17)18(14-23)9-12-25/h5-8,17-18,25H,1-4,9-14H2/p+1/t18-/m0/s1
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