1-ethyl-5-methyl-4-(2-methylpropyl)-2-phenyl-pyrazol-3-one

Systemtic Name: 1-ethyl-5-methyl-4-(2-methylpropyl)-2-phenyl-pyrazol-3-one Openeye Name: 1-ethyl-4-isobutyl-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 1-ethyl-5-methyl-4-(2-methylpropyl)-2-phenyl-3-pyrazolone IUPAC Name: 1-ethyl-5-methyl-4-(2-methylpropyl)-2-phenylpyrazol-3-one Traditional Name: 1-ethyl-4-isobutyl-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C16H22N2O MolecularWeight: 258.35868

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N1C2=CC=CC=C2)CC(C)C)C

Isomeric SMILES

CCN1C(=C(C(=O)N1C2=CC=CC=C2)CC(C)C)C

InChI

InChI=1S/C16H22N2O/c1-5-17-13(4)15(11-12(2)3)16(19)18(17)14-9-7-6-8-10-14/h6-10,12H,5,11H2,1-4H3