sodium; 2-methylpropane; 3-oxidanylidenebutanoate

Systemtic Name: sodium; 2-methylpropane; 3-oxidanylidenebutanoate Openeye Name: sodium; 2-methylpropane; 3-oxobutanoate CAS Name: sodium; 2-methylpropane; 3-oxobutanoate IUPAC Name: sodium; 2-methylpropane; 3-oxobutanoate Traditional Name: sodium; acetoacetate; 2-methylpropane Formula: C8H14NaO3- MolecularWeight: 181.18473

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Descriptors Computed from Structure

Canonical SMILES:

C[C-](C)C.CC(=O)CC(=O)[O-].[Na+]

Isomeric SMILES

C[C-](C)C.CC(=O)CC(=O)[O-].[Na+]

InChI

InChI=1S/C4H6O3.C4H9.Na/c1-3(5)2-4(6)7;1-4(2)3;/h2H2,1H3,(H,6,7);1-3H3;/q;-1;+1/p-1