1-[1-(3-chloranyl-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethanone

Systemtic Name: 1-[1-(3-chloranyl-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethanone Openeye Name: 1-[1-(3-chloro-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethanone CAS Name: 1-[1-(3-chloro-4-methylphenyl)-5-methyl-4-pyrazolyl]ethanone IUPAC Name: 1-[1-(3-chloro-4-methylphenyl)-5-methylpyrazol-4-yl]ethanone Traditional Name: 1-[1-(3-chloro-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethanone Formula: C13H13ClN2O MolecularWeight: 248.70812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN2O/c1-8-4-5-11(6-13(8)14)16-9(2)12(7-15-16)10(3)17/h4-7H,1-3H3