sodium 2-hexoxycarbonyloxybenzenesulfonate

Systemtic Name: sodium 2-hexoxycarbonyloxybenzenesulfonate Openeye Name: sodium 2-hexoxycarbonyloxybenzenesulfonate CAS Name: sodium 2-[hexoxy(oxo)methoxy]benzenesulfonate IUPAC Name: sodium 2-hexoxycarbonyloxybenzenesulfonate Traditional Name: sodium 2-hexoxycarbonyloxybesylate Formula: C13H17NaO6S MolecularWeight: 324.32525

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O6S.Na/c1-2-3-4-7-10-18-13(14)19-11-8-5-6-9-12(11)20(15,16)17;/h5-6,8-9H,2-4,7,10H2,1H3,(H,15,16,17);/q;+1/p-1