2-(2,6-dimethylphenyl)-4H-pyrazol-3-one

Systemtic Name: 2-(2,6-dimethylphenyl)-4H-pyrazol-3-one Openeye Name: 2-(2,6-dimethylphenyl)-4H-pyrazol-3-one CAS Name: 2-(2,6-dimethylphenyl)-4H-pyrazol-3-one IUPAC Name: 2-(2,6-dimethylphenyl)-4H-pyrazol-3-one Traditional Name: 2-(2,6-dimethylphenyl)-2-pyrazolin-3-one Formula: C11H12N2O MolecularWeight: 188.22578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O/c1-8-4-3-5-9(2)11(8)13-10(14)6-7-12-13/h3-5,7H,6H2,1-2H3