3-(2-ethyl-4-oxidanyl-pentanoyl)oxypropane-1-sulfonic acid

Systemtic Name: 3-(2-ethyl-4-oxidanyl-pentanoyl)oxypropane-1-sulfonic acid Openeye Name: 3-(2-ethyl-4-hydroxy-pentanoyl)oxypropane-1-sulfonic acid CAS Name: 3-(2-ethyl-4-hydroxy-1-oxopentoxy)-1-propanesulfonic acid IUPAC Name: 3-(2-ethyl-4-hydroxypentanoyl)oxypropane-1-sulfonic acid Traditional Name: 3-(2-ethyl-4-hydroxy-pentanoyl)oxypropane-1-sulfonic acid Formula: C10H20O6S MolecularWeight: 268.3272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)O)C(=O)OCCCS(=O)(=O)O

Isomeric SMILES

CCC(CC(C)O)C(=O)OCCCS(=O)(=O)O

InChI

InChI=1S/C10H20O6S/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)