1,2-dimethyl-3-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-2-ium chloride

Systemtic Name: 1,2-dimethyl-3-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-2-ium chloride Openeye Name: 1,2-dimethyl-3-(p-tolyl)-5-(trifluoromethyl)pyrazol-2-ium chloride CAS Name: 1,2-dimethyl-3-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-2-ium chloride IUPAC Name: 1,2-dimethyl-3-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-2-ium chloride Traditional Name: 1,2-dimethyl-3-(p-tolyl)-5-(trifluoromethyl)pyrazol-2-ium chloride Formula: C13H14ClF3N2 MolecularWeight: 290.71187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=[N+](N(C(=C2)C(F)(F)F)C)C.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=[N+](N(C(=C2)C(F)(F)F)C)C.[Cl-]

InChI

InChI=1S/C13H14F3N2.ClH/c1-9-4-6-10(7-5-9)11-8-12(13(14,15)16)18(3)17(11)2;/h4-8H,1-3H3;1H/q+1;/p-1