3-butyl-5,5-dimethyl-2-[2,4,6-tris(chloranyl)phenyl]-1,4-dihydropyrazol-2-ium

Systemtic Name: 3-butyl-5,5-dimethyl-2-[2,4,6-tris(chloranyl)phenyl]-1,4-dihydropyrazol-2-ium Openeye Name: 3-butyl-5,5-dimethyl-2-(2,4,6-trichlorophenyl)-1,4-dihydropyrazol-2-ium CAS Name: 3-butyl-5,5-dimethyl-2-(2,4,6-trichlorophenyl)-1,4-dihydropyrazol-2-ium IUPAC Name: 3-butyl-5,5-dimethyl-2-(2,4,6-trichlorophenyl)-1,4-dihydropyrazol-2-ium Traditional Name: 5-butyl-3,3-dimethyl-1-(2,4,6-trichlorophenyl)-2-pyrazolin-1-ium Formula: C15H20Cl3N2+ MolecularWeight: 334.6917

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[N+](NC(C1)(C)C)C2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCCC1=[N+](NC(C1)(C)C)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C15H20Cl3N2/c1-4-5-6-11-9-15(2,3)19-20(11)14-12(17)7-10(16)8-13(14)18/h7-8,19H,4-6,9H2,1-3H3/q+1