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1-[(3-fluorophenyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-ium
1-[(3-fluorophenyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazin-1-ium
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Descriptors Computed from Structure
Canonical SMILES:
C1CN(CC[NH+]1CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F
Isomeric SMILES
C1CN(CC[NH+]1CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F
InChI
InChI=1S/C18H18F4N2O2S/c19-16-3-1-2-14(12-16)13-23-8-10-24(11-9-23)27(25,26)17-6-4-15(5-7-17)18(20,21)22/h1-7,12H,8-11,13H2/p+1
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- 2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanamide
- 2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanamide
