sodium 3-(2-ethyl-4-oxidanyl-pentanoyl)oxypropane-1-sulfonate

Systemtic Name: sodium 3-(2-ethyl-4-oxidanyl-pentanoyl)oxypropane-1-sulfonate Openeye Name: sodium 3-(2-ethyl-4-hydroxy-pentanoyl)oxypropane-1-sulfonate CAS Name: sodium 3-(2-ethyl-4-hydroxy-1-oxopentoxy)-1-propanesulfonate IUPAC Name: sodium 3-(2-ethyl-4-hydroxypentanoyl)oxypropane-1-sulfonate Traditional Name: sodium 3-(2-ethyl-4-hydroxy-pentanoyl)oxypropane-1-sulfonate Formula: C10H19NaO6S MolecularWeight: 290.30903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H20O6S.Na/c1-3-9(7-8(2)11)10(12)16-5-4-6-17(13,14)15;/h8-9,11H,3-7H2,1-2H3,(H,13,14,15);/q;+1/p-1