copper 5-methyl-4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]-2-phenyl-pyrazol-3-olate

Systemtic Name: copper 5-methyl-4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]-2-phenyl-pyrazol-3-olate Openeye Name: copper 5-methyl-4-[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]-2-phenyl-pyrazol-3-olate CAS Name: copper 5-methyl-4-[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-2-phenyl-3-pyrazololate IUPAC Name: copper 5-methyl-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]-2-phenylpyrazol-3-olate Traditional Name: cupric 4-[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-5-methyl-2-phenyl-pyrazol-3-olate Formula: C42H34CuN8O4 MolecularWeight: 778.31656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=C(N(N=C2C)C3=CC=CC=C3)[O-])C4=CC=CC=C4.CC1=NN(C(=O)C1=CC2=C(N(N=C2C)C3=CC=CC=C3)[O-])C4=CC=CC=C4.[Cu+2]

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=C(N(N=C2C)C3=CC=CC=C3)[O-])C4=CC=CC=C4.CC\1=NN(C(=O)/C1=C/C2=C(N(N=C2C)C3=CC=CC=C3)[O-])C4=CC=CC=C4.[Cu+2]

InChI

InChI=1S/2C21H18N4O2.Cu/c2*1-14-18(20(26)24(22-14)16-9-5-3-6-10-16)13-19-15(2)23-25(21(19)27)17-11-7-4-8-12-17;/h2*3-13,26H,1-2H3;/q;;+2/p-2/b2*19-13+;