2-ethyl-3-oxidanylidene-butanoate; 3-oxidanylidenebutanoate

Systemtic Name: 2-ethyl-3-oxidanylidene-butanoate; 3-oxidanylidenebutanoate Openeye Name: 2-ethyl-3-oxo-butanoate; 3-oxobutanoate CAS Name: 2-ethyl-3-oxobutanoate; 3-oxobutanoate IUPAC Name: 2-ethyl-3-oxobutanoate; 3-oxobutanoate Traditional Name: acetoacetate; 2-ethyl-3-keto-butyrate Formula: C10H14O6-2 MolecularWeight: 230.21456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C)C(=O)[O-].CC(=O)CC(=O)[O-]

Isomeric SMILES

CCC(C(=O)C)C(=O)[O-].CC(=O)CC(=O)[O-]

InChI

InChI=1S/C6H10O3.C4H6O3/c1-3-5(4(2)7)6(8)9;1-3(5)2-4(6)7/h5H,3H2,1-2H3,(H,8,9);2H2,1H3,(H,6,7)/p-2