2-oxidanylbutanoate; titanium(4+)

Systemtic Name: 2-oxidanylbutanoate; titanium(4+) Openeye Name: 2-hydroxybutanoate; titanium(4+) CAS Name: 2-hydroxybutanoate; titanium(4+) IUPAC Name: 2-hydroxybutanoate; titanium(4+) Traditional Name: 2-hydroxybutyrate; titanium(4+) Formula: C16H28O12Ti MolecularWeight: 460.25332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C4H8O3.Ti/c4*1-2-3(5)4(6)7;/h4*3,5H,2H2,1H3,(H,6,7);/q;;;;+4/p-4