2-[(E)-N,N'-bis(trimethylsilyl)carbamimidoyl]benzoate; zirconium(4+)

Systemtic Name: 2-[(E)-N,N'-bis(trimethylsilyl)carbamimidoyl]benzoate; zirconium(4+) Openeye Name: 2-[(E)-N,N'-bis(trimethylsilyl)carbamimidoyl]benzoate; zirconium(4+) CAS Name: 2-[(E)-(trimethylsilylamino)-trimethylsilyliminomethyl]benzoate; zirconium(4+) IUPAC Name: 2-[(E)-N,N'-bis(trimethylsilyl)carbamimidoyl]benzoate; zirconium(4+) Traditional Name: 2-[(E)-N,N'-bis(trimethylsilyl)amidino]benzoate; zirconium(4+) Formula: C56H92N8O8Si8Zr MolecularWeight: 1321.28648

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)NC(=N[Si](C)(C)C)C1=CC=CC=C1C(=O)[O-].C[Si](C)(C)NC(=N[Si](C)(C)C)C1=CC=CC=C1C(=O)[O-].C[Si](C)(C)NC(=N[Si](C)(C)C)C1=CC=CC=C1C(=O)[O-].C[Si](C)(C)NC(=N[Si](C)(C)C)C1=CC=CC=C1C(=O)[O-].[Zr+4]

Isomeric SMILES

C[Si](N/C(=N/[Si](C)(C)C)/C1=CC=CC=C1C(=O)[O-])(C)C.C[Si](N/C(=N/[Si](C)(C)C)/C1=CC=CC=C1C(=O)[O-])(C)C.C[Si](N/C(=N/[Si](C)(C)C)/C1=CC=CC=C1C(=O)[O-])(C)C.C[Si](N/C(=N/[Si](C)(C)C)/C1=CC=CC=C1C(=O)[O-])(C)C.[Zr+4]

InChI

InChI=1S/4C14H24N2O2Si2.Zr/c4*1-19(2,3)15-13(16-20(4,5)6)11-9-7-8-10-12(11)14(17)18;/h4*7-10H,1-6H3,(H,15,16)(H,17,18);/q;;;;+4/p-4