4,5-dimethyl-2-(3-phenylbutan-2-yl)-1H-pyrazol-3-one

Systemtic Name: 4,5-dimethyl-2-(3-phenylbutan-2-yl)-1H-pyrazol-3-one Openeye Name: 4,5-dimethyl-2-(1-methyl-2-phenyl-propyl)-1H-pyrazol-3-one CAS Name: 4,5-dimethyl-2-(3-phenylbutan-2-yl)-1H-pyrazol-3-one IUPAC Name: 4,5-dimethyl-2-(3-phenylbutan-2-yl)-1H-pyrazol-3-one Traditional Name: 4,5-dimethyl-2-(1-methyl-2-phenyl-propyl)-3-pyrazolin-3-one Formula: C15H20N2O MolecularWeight: 244.3321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O/c1-10-12(3)16-17(15(10)18)13(4)11(2)14-8-6-5-7-9-14/h5-9,11,13,16H,1-4H3