1-(4-methylphenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone

Systemtic Name: 1-(4-methylphenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone Openeye Name: 1-(p-tolyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone CAS Name: 1-(4-methylphenyl)-2-[2-(trifluoromethyl)-2-imidazolidine-1,3-diiumyl]ethanone IUPAC Name: 1-(4-methylphenyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone Traditional Name: 1-(p-tolyl)-2-[2-(trifluoromethyl)imidazolidine-1,3-diium-2-yl]ethanone Formula: C13H17F3N2O+2 MolecularWeight: 274.28209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC2([NH2+]CC[NH2+]2)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC2([NH2+]CC[NH2+]2)C(F)(F)F

InChI

InChI=1S/C13H15F3N2O/c1-9-2-4-10(5-3-9)11(19)8-12(13(14,15)16)17-6-7-18-12/h2-5,17-18H,6-8H2,1H3/p+2