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1-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium
1-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium
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Canonical SMILES:
COC1=C(C=C(C(=C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-])OC
Isomeric SMILES
COC1=C(C=C(C(=C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-])OC
InChI
InChI=1S/C20H22F3N3O4/c1-29-18-10-14(17(26(27)28)12-19(18)30-2)13-24-6-8-25(9-7-24)16-5-3-4-15(11-16)20(21,22)23/h3-5,10-12H,6-9,13H2,1-2H3/p+1
 
      
		
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