2-(2-chloranyl-6-ethyl-phenyl)-5-methyl-1H-pyrazol-3-one

Systemtic Name: 2-(2-chloranyl-6-ethyl-phenyl)-5-methyl-1H-pyrazol-3-one Openeye Name: 2-(2-chloro-6-ethyl-phenyl)-5-methyl-1H-pyrazol-3-one CAS Name: 2-(2-chloro-6-ethylphenyl)-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-(2-chloro-6-ethylphenyl)-5-methyl-1H-pyrazol-3-one Traditional Name: 2-(2-chloro-6-ethyl-phenyl)-5-methyl-3-pyrazolin-3-one Formula: C12H13ClN2O MolecularWeight: 236.69742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)Cl)N2C(=O)C=C(N2)C

Isomeric SMILES

CCC1=C(C(=CC=C1)Cl)N2C(=O)C=C(N2)C

InChI

InChI=1S/C12H13ClN2O/c1-3-9-5-4-6-10(13)12(9)15-11(16)7-8(2)14-15/h4-7,14H,3H2,1-2H3