ethanol; ethyl 3-oxidanylidenebutanoate; zirconium

Systemtic Name: ethanol; ethyl 3-oxidanylidenebutanoate; zirconium Openeye Name: ethanol; ethyl 3-oxobutanoate; zirconium CAS Name: ethanol; 3-oxobutanoic acid ethyl ester; zirconium IUPAC Name: ethanol; ethyl 3-oxobutanoate; zirconium Traditional Name: ethanol; 3-ketobutyric acid ethyl ester; zirconium Formula: C12H28O6Zr MolecularWeight: 359.57112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCO.CCO.CCO.CCOC(=O)CC(=O)C.[Zr]

Isomeric SMILES

CCO.CCO.CCO.CCOC(=O)CC(=O)C.[Zr]

InChI

InChI=1S/C6H10O3.3C2H6O.Zr/c1-3-9-6(8)4-5(2)7;3*1-2-3;/h3-4H2,1-2H3;3*3H,2H2,1H3;