3-oxidanylidenebutanoate; oxygen(2-); vanadium

Systemtic Name: 3-oxidanylidenebutanoate; oxygen(2-); vanadium Openeye Name: 3-oxobutanoate; oxygen(2-); vanadium CAS Name: 3-oxobutanoate; oxygen(2-); vanadium IUPAC Name: 3-oxobutanoate; oxygen(2-); vanadium Traditional Name: acetoacetate; oxygen(2-); vanadium Formula: C20H25O20V3-15 MolecularWeight: 738.225

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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-].CC(=O)CC(=O)[O-].[O-2].[O-2].[O-2].[O-2].[O-2].[V].[V].[V]

Isomeric SMILES

CC(=O)CC(=O)[O-].CC(=O)CC(=O)[O-].CC(=O)CC(=O)[O-].CC(=O)CC(=O)[O-].CC(=O)CC(=O)[O-].[O-2].[O-2].[O-2].[O-2].[O-2].[V].[V].[V]

InChI

InChI=1S/5C4H6O3.5O.3V/c5*1-3(5)2-4(6)7;;;;;;;;/h5*2H2,1H3,(H,6,7);;;;;;;;/q;;;;;5*-2;;;/p-5