butan-1-olate; 2,2-diethyl-3-oxidanylidene-hexanoate; zirconium(4+)

Systemtic Name: butan-1-olate; 2,2-diethyl-3-oxidanylidene-hexanoate; zirconium(4+) Openeye Name: butan-1-olate; 2,2-diethyl-3-oxo-hexanoate; zirconium(4+) CAS Name: 1-butanolate; 2,2-diethyl-3-oxohexanoate; zirconium(4+) IUPAC Name: butan-1-olate; 2,2-diethyl-3-oxohexanoate; zirconium(4+) Traditional Name: butan-1-olate; 2,2-diethyl-3-keto-hexanoate; zirconium(4+) Formula: C28H52O8Zr MolecularWeight: 607.93168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C10H18O3.2C4H9O.Zr/c2*1-4-7-8(11)10(5-2,6-3)9(12)13;2*1-2-3-4-5;/h2*4-7H2,1-3H3,(H,12,13);2*2-4H2,1H3;/q;;2*-1;+4/p-2