sodium 1-oxidanyl-3-oxidanylidene-dodecane-1-sulfonate

Systemtic Name: sodium 1-oxidanyl-3-oxidanylidene-dodecane-1-sulfonate Openeye Name: sodium 1-hydroxy-3-oxo-dodecane-1-sulfonate CAS Name: sodium 1-hydroxy-3-oxo-1-dodecanesulfonate IUPAC Name: sodium 1-hydroxy-3-oxododecane-1-sulfonate Traditional Name: sodium 1-hydroxy-3-keto-dodecane-1-sulfonate Formula: C12H23NaO5S MolecularWeight: 302.36279

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)CC(O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCC(=O)CC(O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H24O5S.Na/c1-2-3-4-5-6-7-8-9-11(13)10-12(14)18(15,16)17;/h12,14H,2-10H2,1H3,(H,15,16,17);/q;+1/p-1