5-(3-phenylbutan-2-yl)pyrazol-3-one

Systemtic Name: 5-(3-phenylbutan-2-yl)pyrazol-3-one Openeye Name: 5-(1-methyl-2-phenyl-propyl)pyrazol-3-one CAS Name: 5-(3-phenylbutan-2-yl)-3-pyrazolone IUPAC Name: 5-(3-phenylbutan-2-yl)pyrazol-3-one Traditional Name: 5-(1-methyl-2-phenyl-propyl)pyrazol-3-one Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(C)C2=CC(=O)N=N2

Isomeric SMILES

CC(C1=CC=CC=C1)C(C)C2=CC(=O)N=N2

InChI

InChI=1S/C13H14N2O/c1-9(11-6-4-3-5-7-11)10(2)12-8-13(16)15-14-12/h3-10H,1-2H3