1-[(2-methylphenyl)methyl]-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium

Systemtic Name: 1-[(2-methylphenyl)methyl]-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Openeye Name: 1-(o-tolylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium CAS Name: 1-[(2-methylphenyl)methyl]-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium IUPAC Name: 1-[(2-methylphenyl)methyl]-4-[[2-(trifluoromethyl)phenyl]methyl]piperazine-1,4-diium Traditional Name: 1-(2-methylbenzyl)-4-[2-(trifluoromethyl)benzyl]piperazine-1,4-diium Formula: C20H25F3N2+2 MolecularWeight: 350.42111

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H23F3N2/c1-16-6-2-3-7-17(16)14-24-10-12-25(13-11-24)15-18-8-4-5-9-19(18)20(21,22)23/h2-9H,10-15H2,1H3/p+2