1,5-dimethyl-2-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-1-ium-3-one

Systemtic Name: 1,5-dimethyl-2-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-1-ium-3-one Openeye Name: 1,5-dimethyl-2-(2,4,6-trichlorophenyl)-4H-pyrazol-1-ium-3-one CAS Name: 1,5-dimethyl-2-(2,4,6-trichlorophenyl)-4H-pyrazol-1-ium-3-one IUPAC Name: 1,5-dimethyl-2-(2,4,6-trichlorophenyl)-4H-pyrazol-1-ium-3-one Traditional Name: 1,5-dimethyl-2-(2,4,6-trichlorophenyl)-2-pyrazolin-1-ium-3-one Formula: C11H10Cl3N2O+ MolecularWeight: 292.5689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](N(C(=O)C1)C2=C(C=C(C=C2Cl)Cl)Cl)C

Isomeric SMILES

CC1=[N+](N(C(=O)C1)C2=C(C=C(C=C2Cl)Cl)Cl)C

InChI

InChI=1S/C11H10Cl3N2O/c1-6-3-10(17)16(15(6)2)11-8(13)4-7(12)5-9(11)14/h4-5H,3H2,1-2H3/q+1