2-carbamimidoyl-6-trimethylsilyl-benzoate; zirconium(2+); dichloride

Systemtic Name: 2-carbamimidoyl-6-trimethylsilyl-benzoate; zirconium(2+); dichloride Openeye Name: 2-carbamimidoyl-6-trimethylsilyl-benzoate; zirconium(2+); dichloride CAS Name: 2-carbamimidoyl-6-trimethylsilylbenzoate; zirconium(2+); dichloride IUPAC Name: 2-carbamimidoyl-6-trimethylsilylbenzoate; zirconium(2+); dichloride Traditional Name: 2-amidino-6-trimethylsilyl-benzoate; zirconium(2+); dichloride Formula: C44H60Cl2N8O8Si4Zr-4 MolecularWeight: 1103.468

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.C[Si](C)(C)C1=CC=CC(=C1C(=O)[O-])C(=N)N.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/4C11H16N2O2Si.2ClH.Zr/c4*1-16(2,3)8-6-4-5-7(10(12)13)9(8)11(14)15;;;/h4*4-6H,1-3H3,(H3,12,13)(H,14,15);2*1H;/q;;;;;;+2/p-6