2,3,3-triethyl-2-oxidanyl-pentanoate; zirconium(2+)

Systemtic Name: 2,3,3-triethyl-2-oxidanyl-pentanoate; zirconium(2+) Openeye Name: 2,3,3-triethyl-2-hydroxy-pentanoate; zirconium(2+) CAS Name: 2,3,3-triethyl-2-hydroxypentanoate; zirconium(2+) IUPAC Name: 2,3,3-triethyl-2-hydroxypentanoate; zirconium(2+) Traditional Name: 2,3,3-triethyl-2-hydroxy-valerate; zirconium(2+) Formula: C22H42O6Zr MolecularWeight: 493.78928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C11H22O3.Zr/c2*1-5-10(6-2,7-3)11(14,8-4)9(12)13;/h2*14H,5-8H2,1-4H3,(H,12,13);/q;;+2/p-2