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

Systemtic Name: 2-ethyl-3-oxidanylidene-butanoate; propan-1-ol; titanium(2+) Openeye Name: 2-ethyl-3-oxo-butanoate; propan-1-ol; titanium(2+) CAS Name: 2-ethyl-3-oxobutanoate; 1-propanol; titanium(2+) IUPAC Name: 2-ethyl-3-oxobutanoate; propan-1-ol; titanium(2+) Traditional Name: 2-ethyl-3-keto-butyrate; propan-1-ol; titanium(2+) Formula: C18H34O8Ti MolecularWeight: 426.32476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H10O3.2C3H8O.Ti/c2*1-3-5(4(2)7)6(8)9;2*1-2-3-4;/h2*5H,3H2,1-2H3,(H,8,9);2*4H,2-3H2,1H3;/q;;;;+2/p-2