5-methyl-4-[(4-methylphenyl)methyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-methyl-4-[(4-methylphenyl)methyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-methyl-4-(p-tolylmethyl)-1,2-dihydropyrazol-3-one CAS Name: 5-methyl-4-[(4-methylphenyl)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-[(4-methylphenyl)methyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-methyl-4-(4-methylbenzyl)-3-pyrazolin-3-one Formula: C12H14N2O MolecularWeight: 202.25236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C(NNC2=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C(NNC2=O)C

InChI

InChI=1S/C12H14N2O/c1-8-3-5-10(6-4-8)7-11-9(2)13-14-12(11)15/h3-6H,7H2,1-2H3,(H2,13,14,15)