5-ethoxy-3-ethoxycarbonyl-3-oxidanyl-5-oxidanylidene-pentanoate; zirconium(2+)

Systemtic Name: 5-ethoxy-3-ethoxycarbonyl-3-oxidanyl-5-oxidanylidene-pentanoate; zirconium(2+) Openeye Name: 5-ethoxy-3-ethoxycarbonyl-3-hydroxy-5-oxo-pentanoate; zirconium(2+) CAS Name: 5-ethoxy-3-ethoxycarbonyl-3-hydroxy-5-oxopentanoate; zirconium(2+) IUPAC Name: 5-ethoxy-3-ethoxycarbonyl-3-hydroxy-5-oxopentanoate; zirconium(2+) Traditional Name: 3-carbethoxy-5-ethoxy-3-hydroxy-5-keto-valerate; zirconium(2+) Formula: C20H30O14Zr MolecularWeight: 585.6678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C10H16O7.Zr/c2*1-3-16-8(13)6-10(15,5-7(11)12)9(14)17-4-2;/h2*15H,3-6H2,1-2H3,(H,11,12);/q;;+2/p-2