2-ethylhexanoate; zirconium(4+)

Systemtic Name: 2-ethylhexanoate; zirconium(4+) Openeye Name: 2-ethylhexanoate; zirconium(4+) CAS Name: 2-ethylhexanoate; zirconium(4+) IUPAC Name: 2-ethylhexanoate; zirconium(4+) Traditional Name: 2-ethylhexanoate; zirconium(4+) Formula: C32H60O8Zr MolecularWeight: 664.038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C8H16O2.Zr/c4*1-3-5-6-7(4-2)8(9)10;/h4*7H,3-6H2,1-2H3,(H,9,10);/q;;;;+4/p-4