2-ethyl-3-oxidanylidene-butanoate; 2-methylpropan-1-ol; titanium(2+)

Systemtic Name: 2-ethyl-3-oxidanylidene-butanoate; 2-methylpropan-1-ol; titanium(2+) Openeye Name: 2-ethyl-3-oxo-butanoate; 2-methylpropan-1-ol; titanium(2+) CAS Name: 2-ethyl-3-oxobutanoate; 2-methyl-1-propanol; titanium(2+) IUPAC Name: 2-ethyl-3-oxobutanoate; 2-methylpropan-1-ol; titanium(2+) Traditional Name: 2-ethyl-3-keto-butyrate; 2-methylpropan-1-ol; titanium(2+) Formula: C22H37O10Ti- MolecularWeight: 509.39018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CC(C)CO.[Ti+2]

Isomeric SMILES

CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CC(C)CO.[Ti+2]

InChI

InChI=1S/3C6H10O3.C4H10O.Ti/c3*1-3-5(4(2)7)6(8)9;1-4(2)3-5;/h3*5H,3H2,1-2H3,(H,8,9);4-5H,3H2,1-2H3;/q;;;;+2/p-3