2,4,4-tributoxy-2-ethyl-3-oxidanylidene-butanoate; zirconium(4+)

Systemtic Name: 2,4,4-tributoxy-2-ethyl-3-oxidanylidene-butanoate; zirconium(4+) Openeye Name: 2,4,4-tributoxy-2-ethyl-3-oxo-butanoate; zirconium(4+) CAS Name: 2,4,4-tributoxy-2-ethyl-3-oxobutanoate; zirconium(4+) IUPAC Name: 2,4,4-tributoxy-2-ethyl-3-oxobutanoate; zirconium(4+) Traditional Name: 2,4,4-tributoxy-2-ethyl-3-keto-butyrate; zirconium(4+) Formula: C18H33O6Zr+3 MolecularWeight: 436.67502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34O6.Zr/c1-5-9-12-22-16(23-13-10-6-2)15(19)18(8-4,17(20)21)24-14-11-7-3;/h16H,5-14H2,1-4H3,(H,20,21);/q;+4/p-1