2-(phenylmethyl)-5-propan-2-yl-4H-pyrazol-3-one

Systemtic Name: 2-(phenylmethyl)-5-propan-2-yl-4H-pyrazol-3-one Openeye Name: 2-benzyl-5-isopropyl-4H-pyrazol-3-one CAS Name: 2-(phenylmethyl)-5-propan-2-yl-4H-pyrazol-3-one IUPAC Name: 2-benzyl-5-propan-2-yl-4H-pyrazol-3-one Traditional Name: 2-benzyl-5-isopropyl-2-pyrazolin-3-one Formula: C13H16N2O MolecularWeight: 216.27894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O/c1-10(2)12-8-13(16)15(14-12)9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3