ethyl 3-oxidanylidenebutanoate; titanium(2+)

Systemtic Name: ethyl 3-oxidanylidenebutanoate; titanium(2+) Openeye Name: ethyl 3-oxobutanoate; titanium(2+) CAS Name: 3-oxobutanoic acid ethyl ester; titanium(2+) IUPAC Name: ethyl 3-oxobutanoate; titanium(2+) Traditional Name: 3-ketobutyric acid ethyl ester; titanium(2+) Formula: C24H40O12Ti+2 MolecularWeight: 568.4342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C.CCOC(=O)CC(=O)C.CCOC(=O)CC(=O)C.CCOC(=O)CC(=O)C.[Ti+2]

Isomeric SMILES

CCOC(=O)CC(=O)C.CCOC(=O)CC(=O)C.CCOC(=O)CC(=O)C.CCOC(=O)CC(=O)C.[Ti+2]

InChI

InChI=1S/4C6H10O3.Ti/c4*1-3-9-6(8)4-5(2)7;/h4*3-4H2,1-2H3;/q;;;;+2