bis(oxidanyl)-oxidanylidene-titanium; 3-ethyl-2,4-bis(oxidanylidene)pentanoic acid; propan-2-ol

Systemtic Name: bis(oxidanyl)-oxidanylidene-titanium; 3-ethyl-2,4-bis(oxidanylidene)pentanoic acid; propan-2-ol Openeye Name: dihydroxy(oxo)titanium; 3-ethyl-2,4-dioxo-pentanoic acid; propan-2-ol CAS Name: dihydroxy(oxo)titanium; 3-ethyl-2,4-dioxopentanoic acid; 2-propanol IUPAC Name: dihydroxy(oxo)titanium; 3-ethyl-2,4-dioxopentanoic acid; propan-2-ol Traditional Name: dihydroxy(keto)titanium; 3-ethyl-2,4-diketo-valeric acid; propan-2-ol Formula: C20H38O13Ti MolecularWeight: 534.37492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C)C(=O)C(=O)O.CCC(C(=O)C)C(=O)C(=O)O.CC(C)O.CC(C)O.O[Ti](=O)O

Isomeric SMILES

CCC(C(=O)C)C(=O)C(=O)O.CCC(C(=O)C)C(=O)C(=O)O.CC(C)O.CC(C)O.O[Ti](=O)O

InChI

InChI=1S/2C7H10O4.2C3H8O.2H2O.O.Ti/c2*1-3-5(4(2)8)6(9)7(10)11;2*1-3(2)4;;;;/h2*5H,3H2,1-2H3,(H,10,11);2*3-4H,1-2H3;2*1H2;;/q;;;;;;;+2/p-2