4-ethyl-3-oxidanylidene-hexanoate; zirconium(4+)

Systemtic Name: 4-ethyl-3-oxidanylidene-hexanoate; zirconium(4+) Openeye Name: 4-ethyl-3-oxo-hexanoate; zirconium(4+) CAS Name: 4-ethyl-3-oxohexanoate; zirconium(4+) IUPAC Name: 4-ethyl-3-oxohexanoate; zirconium(4+) Traditional Name: 4-ethyl-3-keto-hexanoate; zirconium(4+) Formula: C32H52O12Zr MolecularWeight: 719.97208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)CC(=O)[O-].CCC(CC)C(=O)CC(=O)[O-].CCC(CC)C(=O)CC(=O)[O-].CCC(CC)C(=O)CC(=O)[O-].[Zr+4]

Isomeric SMILES

CCC(CC)C(=O)CC(=O)[O-].CCC(CC)C(=O)CC(=O)[O-].CCC(CC)C(=O)CC(=O)[O-].CCC(CC)C(=O)CC(=O)[O-].[Zr+4]

InChI

InChI=1S/4C8H14O3.Zr/c4*1-3-6(4-2)7(9)5-8(10)11;/h4*6H,3-5H2,1-2H3,(H,10,11);/q;;;;+4/p-4