3-oxidanylidenehexanoate; titanium(2+)

Systemtic Name: 3-oxidanylidenehexanoate; titanium(2+) Openeye Name: 3-oxohexanoate; titanium(2+) CAS Name: 3-oxohexanoate; titanium(2+) IUPAC Name: 3-oxohexanoate; titanium(2+) Traditional Name: 3-ketohexanoate; titanium(2+) Formula: C18H27O9Ti- MolecularWeight: 435.26858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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