2-[(4-methylphenyl)methyl]-5-propyl-4H-pyrazol-3-one

Systemtic Name: 2-[(4-methylphenyl)methyl]-5-propyl-4H-pyrazol-3-one Openeye Name: 5-propyl-2-(p-tolylmethyl)-4H-pyrazol-3-one CAS Name: 2-[(4-methylphenyl)methyl]-5-propyl-4H-pyrazol-3-one IUPAC Name: 2-[(4-methylphenyl)methyl]-5-propyl-4H-pyrazol-3-one Traditional Name: 2-(4-methylbenzyl)-5-propyl-2-pyrazolin-3-one Formula: C14H18N2O MolecularWeight: 230.30552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1)CC2=CC=C(C=C2)C

Isomeric SMILES

CCCC1=NN(C(=O)C1)CC2=CC=C(C=C2)C

InChI

InChI=1S/C14H18N2O/c1-3-4-13-9-14(17)16(15-13)10-12-7-5-11(2)6-8-12/h5-8H,3-4,9-10H2,1-2H3