2-[3,5-bis(chloranyl)phenyl]-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one

Systemtic Name: 2-[3,5-bis(chloranyl)phenyl]-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one Openeye Name: 2-(3,5-dichlorophenyl)-5-methyl-4-(p-tolylmethylene)pyrazol-3-one CAS Name: 2-(3,5-dichlorophenyl)-5-methyl-4-[(4-methylphenyl)methylidene]-3-pyrazolone IUPAC Name: 2-(3,5-dichlorophenyl)-5-methyl-4-[(4-methylphenyl)methylidene]pyrazol-3-one Traditional Name: 2-(3,5-dichlorophenyl)-5-methyl-4-(4-methylbenzylidene)-2-pyrazolin-3-one Formula: C18H14Cl2N2O MolecularWeight: 345.22256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC(=CC(=C3)Cl)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC(=CC(=C3)Cl)Cl)C

InChI

InChI=1S/C18H14Cl2N2O/c1-11-3-5-13(6-4-11)7-17-12(2)21-22(18(17)23)16-9-14(19)8-15(20)10-16/h3-10H,1-2H3