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

Systemtic Name: 2-(3-methylphenyl)-5-propyl-1H-pyrazol-3-one Openeye Name: 2-(m-tolyl)-5-propyl-1H-pyrazol-3-one CAS Name: 2-(3-methylphenyl)-5-propyl-1H-pyrazol-3-one IUPAC Name: 2-(3-methylphenyl)-5-propyl-1H-pyrazol-3-one Traditional Name: 2-(m-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(=C2)C

Isomeric SMILES

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

InChI

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