trisodium carboxy 3-methylperoxy-3-oxidanylidene-propanoate hydrate

Systemtic Name: trisodium carboxy 3-methylperoxy-3-oxidanylidene-propanoate hydrate Openeye Name: trisodium carboxy 3-methylperoxy-3-oxo-propanoate hydrate CAS Name: trisodium 3-methyldioxy-3-oxopropanoic acid carboxy ester hydrate IUPAC Name: trisodium carboxy 3-methylperoxy-3-oxopropanoate hydrate Traditional Name: trisodium 3-keto-3-methylperoxy-propionic acid carboxy ester hydrate Formula: C5H8Na3O8+3 MolecularWeight: 265.08153

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Descriptors Computed from Structure

Canonical SMILES:

COOC(=O)CC(=O)OC(=O)O.O.[Na+].[Na+].[Na+]

Isomeric SMILES

COOC(=O)CC(=O)OC(=O)O.O.[Na+].[Na+].[Na+]

InChI

InChI=1S/C5H6O7.3Na.H2O/c1-10-12-4(7)2-3(6)11-5(8)9;;;;/h2H2,1H3,(H,8,9);;;;1H2/q;3*+1;