copper 1-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hexan-1-olate

Systemtic Name: copper 1-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hexan-1-olate Openeye Name: copper 1-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)hexan-1-olate CAS Name: copper 1-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)-1-hexanolate IUPAC Name: copper 1-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hexan-1-olate Traditional Name: cupric 1-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)hexan-1-olate Formula: C32H38CuN4O4 MolecularWeight: 606.21452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)[O-].CCCCCC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)[O-].[Cu+2]

Isomeric SMILES

CCCCCC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)[O-].CCCCCC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)[O-].[Cu+2]

InChI

InChI=1S/2C16H20N2O2.Cu/c2*1-3-4-6-11-14(19)15-12(2)17-18(16(15)20)13-9-7-5-8-10-13;/h2*5,7-10,19H,3-4,6,11H2,1-2H3;/q;;+2/p-2