1-ethyl-5-methyl-2-(phenylmethyl)pyrazol-3-one

Systemtic Name: 1-ethyl-5-methyl-2-(phenylmethyl)pyrazol-3-one Openeye Name: 2-benzyl-1-ethyl-5-methyl-pyrazol-3-one CAS Name: 1-ethyl-5-methyl-2-(phenylmethyl)-3-pyrazolone IUPAC Name: 2-benzyl-1-ethyl-5-methylpyrazol-3-one Traditional Name: 2-benzyl-1-ethyl-5-methyl-3-pyrazolin-3-one Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=O)N1CC2=CC=CC=C2)C

Isomeric SMILES

CCN1C(=CC(=O)N1CC2=CC=CC=C2)C

InChI

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