2-(2,6-dimethylphenyl)-5-methyl-1H-pyrazol-3-one

Systemtic Name: 2-(2,6-dimethylphenyl)-5-methyl-1H-pyrazol-3-one Openeye Name: 2-(2,6-dimethylphenyl)-5-methyl-1H-pyrazol-3-one CAS Name: 2-(2,6-dimethylphenyl)-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-(2,6-dimethylphenyl)-5-methyl-1H-pyrazol-3-one Traditional Name: 2-(2,6-dimethylphenyl)-5-methyl-3-pyrazolin-3-one Formula: C12H14N2O MolecularWeight: 202.25236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O/c1-8-5-4-6-9(2)12(8)14-11(15)7-10(3)13-14/h4-7,13H,1-3H3