2,2-dibutoxy-4-ethyl-3-oxidanylidene-hexanoate; zirconium(2+)

Systemtic Name: 2,2-dibutoxy-4-ethyl-3-oxidanylidene-hexanoate; zirconium(2+) Openeye Name: 2,2-dibutoxy-4-ethyl-3-oxo-hexanoate; zirconium(2+) CAS Name: 2,2-dibutoxy-4-ethyl-3-oxohexanoate; zirconium(2+) IUPAC Name: 2,2-dibutoxy-4-ethyl-3-oxohexanoate; zirconium(2+) Traditional Name: 2,2-dibutoxy-4-ethyl-3-keto-hexanoate; zirconium(2+) Formula: C32H58O10Zr MolecularWeight: 694.02092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C(=O)C(CC)CC)(C(=O)[O-])OCCCC.CCCCOC(C(=O)C(CC)CC)(C(=O)[O-])OCCCC.[Zr+2]

Isomeric SMILES

CCCCOC(C(=O)C(CC)CC)(C(=O)[O-])OCCCC.CCCCOC(C(=O)C(CC)CC)(C(=O)[O-])OCCCC.[Zr+2]

InChI

InChI=1S/2C16H30O5.Zr/c2*1-5-9-11-20-16(15(18)19,21-12-10-6-2)14(17)13(7-3)8-4;/h2*13H,5-12H2,1-4H3,(H,18,19);/q;;+2/p-2