disodium 2-(2-acetyloxypropyl)-3-methyl-butanedioate

Systemtic Name: disodium 2-(2-acetyloxypropyl)-3-methyl-butanedioate Openeye Name: disodium 2-(2-acetoxypropyl)-3-methyl-butanedioate CAS Name: disodium 2-(2-acetyloxypropyl)-3-methylbutanedioate IUPAC Name: disodium 2-(2-acetyloxypropyl)-3-methylbutanedioate Traditional Name: disodium 2-(2-acetoxypropyl)-3-methyl-succinate Formula: C10H14Na2O6 MolecularWeight: 276.1941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16O6.2Na/c1-5(16-7(3)11)4-8(10(14)15)6(2)9(12)13;;/h5-6,8H,4H2,1-3H3,(H,12,13)(H,14,15);;/q;2*+1/p-2