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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2C(=NNC2=O)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2C(=NNC2=O)C

InChI

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