5-methyl-2-[2-[4-(2-methylpropyl)phenyl]propanoyl]-4H-pyrazol-3-one

Systemtic Name: 5-methyl-2-[2-[4-(2-methylpropyl)phenyl]propanoyl]-4H-pyrazol-3-one Openeye Name: 2-[2-(4-isobutylphenyl)propanoyl]-5-methyl-4H-pyrazol-3-one CAS Name: 5-methyl-2-[2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]-4H-pyrazol-3-one IUPAC Name: 5-methyl-2-[2-[4-(2-methylpropyl)phenyl]propanoyl]-4H-pyrazol-3-one Traditional Name: 2-[2-(4-isobutylphenyl)propanoyl]-5-methyl-2-pyrazolin-3-one Formula: C17H22N2O2 MolecularWeight: 286.36878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C(=O)C(C)C2=CC=C(C=C2)CC(C)C

Isomeric SMILES

CC1=NN(C(=O)C1)C(=O)C(C)C2=CC=C(C=C2)CC(C)C

InChI

InChI=1S/C17H22N2O2/c1-11(2)9-14-5-7-15(8-6-14)13(4)17(21)19-16(20)10-12(3)18-19/h5-8,11,13H,9-10H2,1-4H3