3-ethyl-3-octanoyl-1,3-oxazolidin-3-ium-2-sulfonic acid

Systemtic Name: 3-ethyl-3-octanoyl-1,3-oxazolidin-3-ium-2-sulfonic acid Openeye Name: 3-ethyl-3-octanoyl-oxazolidin-3-ium-2-sulfonic acid CAS Name: 3-ethyl-3-(1-oxooctyl)-2-oxazolidin-3-iumsulfonic acid IUPAC Name: 3-ethyl-3-octanoyl-1,3-oxazolidin-3-ium-2-sulfonic acid Traditional Name: 3-caprylyl-3-ethyl-oxazolidin-3-ium-2-sulfonic acid Formula: C13H26NO5S+ MolecularWeight: 308.41424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)[N+]1(CCOC1S(=O)(=O)O)CC

Isomeric SMILES

CCCCCCCC(=O)[N+]1(CCOC1S(=O)(=O)O)CC

InChI

InChI=1S/C13H25NO5S/c1-3-5-6-7-8-9-12(15)14(4-2)10-11-19-13(14)20(16,17)18/h13H,3-11H2,1-2H3/p+1