4-[2,4-bis(chloranyl)-3-methyl-phenyl]carbonyl-2,5-dimethyl-1H-pyrazol-3-one

Systemtic Name: 4-[2,4-bis(chloranyl)-3-methyl-phenyl]carbonyl-2,5-dimethyl-1H-pyrazol-3-one Openeye Name: 4-(2,4-dichloro-3-methyl-benzoyl)-2,5-dimethyl-1H-pyrazol-3-one CAS Name: 4-[(2,4-dichloro-3-methylphenyl)-oxomethyl]-2,5-dimethyl-1H-pyrazol-3-one IUPAC Name: 4-(2,4-dichloro-3-methylbenzoyl)-2,5-dimethyl-1H-pyrazol-3-one Traditional Name: 4-(2,4-dichloro-3-methyl-benzoyl)-2,5-dimethyl-3-pyrazolin-3-one Formula: C13H12Cl2N2O2 MolecularWeight: 299.15258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)C(=O)C2=C(NN(C2=O)C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1Cl)C(=O)C2=C(NN(C2=O)C)C)Cl

InChI

InChI=1S/C13H12Cl2N2O2/c1-6-9(14)5-4-8(11(6)15)12(18)10-7(2)16-17(3)13(10)19/h4-5,16H,1-3H3