bis(oxidanyl)-oxidanylidene-titanium; ethyl 3-oxidanylidenebutanoate; ethyl 3-oxidanylidene-2,2-di(propan-2-yloxy)butanoate

Systemtic Name: bis(oxidanyl)-oxidanylidene-titanium; ethyl 3-oxidanylidenebutanoate; ethyl 3-oxidanylidene-2,2-di(propan-2-yloxy)butanoate Openeye Name: dihydroxy(oxo)titanium; ethyl 2,2-diisopropoxy-3-oxo-butanoate; ethyl 3-oxobutanoate CAS Name: dihydroxy(oxo)titanium; 3-oxobutanoic acid ethyl ester; 3-oxo-2,2-di(propan-2-yloxy)butanoic acid ethyl ester IUPAC Name: dihydroxy(oxo)titanium; ethyl 3-oxobutanoate; ethyl 3-oxo-2,2-di(propan-2-yloxy)butanoate Traditional Name: dihydroxy(keto)titanium; 2,2-diisopropoxy-3-keto-butyric acid ethyl ester; 3-ketobutyric acid ethyl ester Formula: C18H34O11Ti MolecularWeight: 474.32296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C.CCOC(=O)C(C(=O)C)(OC(C)C)OC(C)C.O[Ti](=O)O

Isomeric SMILES

CCOC(=O)CC(=O)C.CCOC(=O)C(C(=O)C)(OC(C)C)OC(C)C.O[Ti](=O)O

InChI

InChI=1S/C12H22O5.C6H10O3.2H2O.O.Ti/c1-7-15-11(14)12(10(6)13,16-8(2)3)17-9(4)5;1-3-9-6(8)4-5(2)7;;;;/h8-9H,7H2,1-6H3;3-4H2,1-2H3;2*1H2;;/q;;;;;+2/p-2