6-tert-butyl-3-phenyl-pyridin-2-olate; dimethylazanide; zirconium(4+)

Systemtic Name: 6-tert-butyl-3-phenyl-pyridin-2-olate; dimethylazanide; zirconium(4+) Openeye Name: 6-tert-butyl-3-phenyl-pyridin-2-olate; dimethylazanide; zirconium(4+) CAS Name: 6-tert-butyl-3-phenyl-2-pyridinolate; dimethylazanide; zirconium(4+) IUPAC Name: 6-tert-butyl-3-phenylpyridin-2-olate; dimethylazanide; zirconium(4+) Traditional Name: 6-tert-butyl-3-phenyl-pyridin-2-olate; dimethylazanide; zirconium(4+) Formula: C34H44N4O2Zr MolecularWeight: 631.96276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(C=C1)C2=CC=CC=C2)[O-].CC(C)(C)C1=NC(=C(C=C1)C2=CC=CC=C2)[O-].C[N-]C.C[N-]C.[Zr+4]

Isomeric SMILES

CC(C)(C)C1=NC(=C(C=C1)C2=CC=CC=C2)[O-].CC(C)(C)C1=NC(=C(C=C1)C2=CC=CC=C2)[O-].C[N-]C.C[N-]C.[Zr+4]

InChI

InChI=1S/2C15H17NO.2C2H6N.Zr/c2*1-15(2,3)13-10-9-12(14(17)16-13)11-7-5-4-6-8-11;2*1-3-2;/h2*4-10H,1-3H3,(H,16,17);2*1-2H3;/q;;2*-1;+4/p-2