2-ethyl-3-oxidanylidene-butanoate; titanium(4+)

Systemtic Name: 2-ethyl-3-oxidanylidene-butanoate; titanium(4+) Openeye Name: 2-ethyl-3-oxo-butanoate; titanium(4+) CAS Name: 2-ethyl-3-oxobutanoate; titanium(4+) IUPAC Name: 2-ethyl-3-oxobutanoate; titanium(4+) Traditional Name: 2-ethyl-3-keto-butyrate; titanium(4+) Formula: C18H27O9Ti+ MolecularWeight: 435.26858

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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-].[Ti+4]

Isomeric SMILES

CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].[Ti+4]

InChI

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