propyl 3-oxidanylidenebutanoate; zirconium(2+)

Systemtic Name: propyl 3-oxidanylidenebutanoate; zirconium(2+) Openeye Name: propyl 3-oxobutanoate; zirconium(2+) CAS Name: 3-oxobutanoic acid propyl ester; zirconium(2+) IUPAC Name: propyl 3-oxobutanoate; zirconium(2+) Traditional Name: 3-ketobutyric acid propyl ester; zirconium(2+) Formula: C28H48O12Zr+2 MolecularWeight: 667.89752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C7H12O3.Zr/c4*1-3-4-10-7(9)5-6(2)8;/h4*3-5H2,1-2H3;/q;;;;+2