2-(2-methylphenyl)-5-propyl-1H-pyrazol-3-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N(N1)C2=CC=CC=C2C

Isomeric SMILES

CCCC1=CC(=O)N(N1)C2=CC=CC=C2C

InChI

InChI=1S/C13H16N2O/c1-3-6-11-9-13(16)15(14-11)12-8-5-4-7-10(12)2/h4-5,7-9,14H,3,6H2,1-2H3