4,4-bis(chloranyl)-5-methyl-2-(4-methylphenyl)pyrazol-3-one

Systemtic Name: 4,4-bis(chloranyl)-5-methyl-2-(4-methylphenyl)pyrazol-3-one Openeye Name: 4,4-dichloro-5-methyl-2-(p-tolyl)pyrazol-3-one CAS Name: 4,4-dichloro-5-methyl-2-(4-methylphenyl)-3-pyrazolone IUPAC Name: 4,4-dichloro-5-methyl-2-(4-methylphenyl)pyrazol-3-one Traditional Name: 4,4-dichloro-5-methyl-2-(p-tolyl)-2-pyrazolin-3-one Formula: C11H10Cl2N2O MolecularWeight: 257.1159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(C(=N2)C)(Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(C(=N2)C)(Cl)Cl

InChI

InChI=1S/C11H10Cl2N2O/c1-7-3-5-9(6-4-7)15-10(16)11(12,13)8(2)14-15/h3-6H,1-2H3