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1-[(2,3-dimethoxyphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium
1-[(2,3-dimethoxyphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC=CC(=C1OC)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F
Isomeric SMILES
COC1=CC=CC(=C1OC)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C20H23F3N2O2/c1-26-18-8-3-5-15(19(18)27-2)14-24-9-11-25(12-10-24)17-7-4-6-16(13-17)20(21,22)23/h3-8,13H,9-12,14H2,1-2H3/p+1
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