3,4-bis(oxidanylidene)butanoate; titanium(4+)

Systemtic Name: 3,4-bis(oxidanylidene)butanoate; titanium(4+) Openeye Name: 3,4-dioxobutanoate; titanium(4+) CAS Name: 3,4-dioxobutanoate; titanium(4+) IUPAC Name: 3,4-dioxobutanoate; titanium(4+) Traditional Name: 3,4-diketobutyrate; titanium(4+) Formula: C16H12O16Ti MolecularWeight: 508.12388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C4H4O4.Ti/c4*5-2-3(6)1-4(7)8;/h4*2H,1H2,(H,7,8);/q;;;;+4/p-4