3-oxidanylidenebutanoate; titanium(2+)

Systemtic Name: 3-oxidanylidenebutanoate; titanium(2+) Openeye Name: 3-oxobutanoate; titanium(2+) CAS Name: 3-oxobutanoate; titanium(2+) IUPAC Name: 3-oxobutanoate; titanium(2+) Traditional Name: acetoacetate; titanium(2+) Formula: C16H20O12Ti2 MolecularWeight: 500.0568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C4H6O3.2Ti/c4*1-3(5)2-4(6)7;;/h4*2H2,1H3,(H,6,7);;/q;;;;2*+2/p-4