2-(3-chloranyl-4-methyl-phenyl)-5-ethyl-4H-pyrazol-3-one

Systemtic Name: 2-(3-chloranyl-4-methyl-phenyl)-5-ethyl-4H-pyrazol-3-one Openeye Name: 2-(3-chloro-4-methyl-phenyl)-5-ethyl-4H-pyrazol-3-one CAS Name: 2-(3-chloro-4-methylphenyl)-5-ethyl-4H-pyrazol-3-one IUPAC Name: 2-(3-chloro-4-methylphenyl)-5-ethyl-4H-pyrazol-3-one Traditional Name: 2-(3-chloro-4-methyl-phenyl)-5-ethyl-2-pyrazolin-3-one Formula: C12H13ClN2O MolecularWeight: 236.69742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C1)C2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCC1=NN(C(=O)C1)C2=CC(=C(C=C2)C)Cl

InChI

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