sodium 2-octanoyloxybenzenesulfonate

Systemtic Name: sodium 2-octanoyloxybenzenesulfonate Openeye Name: sodium 2-octanoyloxybenzenesulfonate CAS Name: sodium 2-(1-oxooctoxy)benzenesulfonate IUPAC Name: sodium 2-octanoyloxybenzenesulfonate Traditional Name: sodium 2-caprylyloxybesylate Formula: C14H19NaO5S MolecularWeight: 322.35243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H20O5S.Na/c1-2-3-4-5-6-11-14(15)19-12-9-7-8-10-13(12)20(16,17)18;/h7-10H,2-6,11H2,1H3,(H,16,17,18);/q;+1/p-1