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1-(2,3-dimethylphenyl)-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine
1-(2,3-dimethylphenyl)-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C(=CC=C1)N2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F)C
Isomeric SMILES
CC1=C(C(=CC=C1)N2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F)C
InChI
InChI=1S/C18H20F3N3/c1-13-4-3-5-16(14(13)2)23-8-10-24(11-9-23)17-7-6-15(12-22-17)18(19,20)21/h3-7,12H,8-11H2,1-2H3/p+1
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