1,2-dimethyl-3-phenyl-5-(trichloromethyl)pyrazol-2-ium chloride

Systemtic Name: 1,2-dimethyl-3-phenyl-5-(trichloromethyl)pyrazol-2-ium chloride Openeye Name: 1,2-dimethyl-3-phenyl-5-(trichloromethyl)pyrazol-2-ium chloride CAS Name: 1,2-dimethyl-3-phenyl-5-(trichloromethyl)pyrazol-2-ium chloride IUPAC Name: 1,2-dimethyl-3-phenyl-5-(trichloromethyl)pyrazol-2-ium chloride Traditional Name: 1,2-dimethyl-3-phenyl-5-(trichloromethyl)pyrazol-2-ium chloride Formula: C12H12Cl4N2 MolecularWeight: 326.04908

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C(Cl)(Cl)Cl.[Cl-]

Isomeric SMILES

CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C(Cl)(Cl)Cl.[Cl-]

InChI

InChI=1S/C12H12Cl3N2.ClH/c1-16-10(9-6-4-3-5-7-9)8-11(17(16)2)12(13,14)15;/h3-8H,1-2H3;1H/q+1;/p-1