copper; 5-methyl-2-(4-methylphenyl)-1H-pyrazol-3-one; hydrate

Systemtic Name: copper; 5-methyl-2-(4-methylphenyl)-1H-pyrazol-3-one; hydrate Openeye Name: copper; 5-methyl-2-(p-tolyl)-1H-pyrazol-3-one; hydrate CAS Name: copper; 5-methyl-2-(4-methylphenyl)-1H-pyrazol-3-one; hydrate IUPAC Name: copper; 5-methyl-2-(4-methylphenyl)-1H-pyrazol-3-one; hydrate Traditional Name: copper; 5-methyl-2-(p-tolyl)-3-pyrazolin-3-one; hydrate Formula: C11H14CuN2O2 MolecularWeight: 269.78706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C=C(N2)C.O.[Cu]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C=C(N2)C.O.[Cu]

InChI

InChI=1S/C11H12N2O.Cu.H2O/c1-8-3-5-10(6-4-8)13-11(14)7-9(2)12-13;;/h3-7,12H,1-2H3;;1H2