5-methyl-2-pentyl-4-(phenylcarbonyl)-4H-pyrazol-3-one

Systemtic Name: 5-methyl-2-pentyl-4-(phenylcarbonyl)-4H-pyrazol-3-one Openeye Name: 4-benzoyl-5-methyl-2-pentyl-4H-pyrazol-3-one CAS Name: 4-benzoyl-5-methyl-2-pentyl-4H-pyrazol-3-one IUPAC Name: 4-benzoyl-5-methyl-2-pentyl-4H-pyrazol-3-one Traditional Name: 2-amyl-4-benzoyl-5-methyl-2-pyrazolin-3-one Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(C(=N1)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCN1C(=O)C(C(=N1)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2O2/c1-3-4-8-11-18-16(20)14(12(2)17-18)15(19)13-9-6-5-7-10-13/h5-7,9-10,14H,3-4,8,11H2,1-2H3