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

Systemtic Name: butan-1-olate; 2,2-diethyl-3-oxidanylidene-butanoate; zirconium(4+) Openeye Name: butan-1-olate; 2,2-diethyl-3-oxo-butanoate; zirconium(4+) CAS Name: 1-butanolate; 2,2-diethyl-3-oxobutanoate; zirconium(4+) IUPAC Name: butan-1-olate; 2,2-diethyl-3-oxobutanoate; zirconium(4+) Traditional Name: butan-1-olate; 2,2-diethyl-3-keto-butyrate; zirconium(4+) Formula: C16H31O5Zr+ MolecularWeight: 394.63834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H14O3.2C4H9O.Zr/c1-4-8(5-2,6(3)9)7(10)11;2*1-2-3-4-5;/h4-5H2,1-3H3,(H,10,11);2*2-4H2,1H3;/q;2*-1;+4/p-1