4-ethyl-3-oxidanylidene-2,2-di(propan-2-yl)hexanoate; titanium(2+)

Systemtic Name: 4-ethyl-3-oxidanylidene-2,2-di(propan-2-yl)hexanoate; titanium(2+) Openeye Name: 4-ethyl-2,2-diisopropyl-3-oxo-hexanoate; titanium(2+) CAS Name: 4-ethyl-3-oxo-2,2-di(propan-2-yl)hexanoate; titanium(2+) IUPAC Name: 4-ethyl-3-oxo-2,2-di(propan-2-yl)hexanoate; titanium(2+) Traditional Name: 4-ethyl-2,2-diisopropyl-3-keto-hexanoate; titanium(2+) Formula: C28H50O6Ti MolecularWeight: 530.56

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C14H26O3.Ti/c2*1-7-11(8-2)12(15)14(9(3)4,10(5)6)13(16)17;/h2*9-11H,7-8H2,1-6H3,(H,16,17);/q;;+2/p-2