sodium 2-(5-butyl-4-oxidanyl-2-oxidanylidene-oxolan-3-yl)propanoate

Systemtic Name: sodium 2-(5-butyl-4-oxidanyl-2-oxidanylidene-oxolan-3-yl)propanoate Openeye Name: sodium 2-(5-butyl-4-hydroxy-2-oxo-tetrahydrofuran-3-yl)propanoate CAS Name: sodium 2-(5-butyl-4-hydroxy-2-oxo-3-oxolanyl)propanoate IUPAC Name: sodium 2-(5-butyl-4-hydroxy-2-oxooxolan-3-yl)propanoate Traditional Name: sodium 2-(5-butyl-4-hydroxy-2-keto-tetrahydrofuran-3-yl)propionate Formula: C11H17NaO5 MolecularWeight: 252.23945

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(C(C(=O)O1)C(C)C(=O)[O-])O.[Na+]

Isomeric SMILES

CCCCC1C(C(C(=O)O1)C(C)C(=O)[O-])O.[Na+]

InChI

InChI=1S/C11H18O5.Na/c1-3-4-5-7-9(12)8(11(15)16-7)6(2)10(13)14;/h6-9,12H,3-5H2,1-2H3,(H,13,14);/q;+1/p-1