4-ethyl-3-methyl-2-(2-methylphenyl)-1H-pyrazol-5-one

Systemtic Name: 4-ethyl-3-methyl-2-(2-methylphenyl)-1H-pyrazol-5-one Openeye Name: 4-ethyl-3-methyl-2-(o-tolyl)-1H-pyrazol-5-one CAS Name: 4-ethyl-3-methyl-2-(2-methylphenyl)-1H-pyrazol-5-one IUPAC Name: 4-ethyl-3-methyl-2-(2-methylphenyl)-1H-pyrazol-5-one Traditional Name: 4-ethyl-5-methyl-1-(o-tolyl)-3-pyrazolin-3-one Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(NC1=O)C2=CC=CC=C2C)C

Isomeric SMILES

CCC1=C(N(NC1=O)C2=CC=CC=C2C)C

InChI

InChI=1S/C13H16N2O/c1-4-11-10(3)15(14-13(11)16)12-8-6-5-7-9(12)2/h5-8H,4H2,1-3H3,(H,14,16)