5-methyl-2-(1-phenylpropyl)-1H-pyrazol-3-one

Systemtic Name: 5-methyl-2-(1-phenylpropyl)-1H-pyrazol-3-one Openeye Name: 5-methyl-2-(1-phenylpropyl)-1H-pyrazol-3-one CAS Name: 5-methyl-2-(1-phenylpropyl)-1H-pyrazol-3-one IUPAC Name: 5-methyl-2-(1-phenylpropyl)-1H-pyrazol-3-one Traditional Name: 5-methyl-2-(1-phenylpropyl)-3-pyrazolin-3-one Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)N2C(=O)C=C(N2)C

Isomeric SMILES

CCC(C1=CC=CC=C1)N2C(=O)C=C(N2)C

InChI

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