sodium 3-[2-[2-[2-(4-tridecylphenoxy)ethoxy]ethoxy]ethoxy]propane-1-sulfonate

Systemtic Name: sodium 3-[2-[2-[2-(4-tridecylphenoxy)ethoxy]ethoxy]ethoxy]propane-1-sulfonate Openeye Name: sodium 3-[2-[2-[2-(4-tridecylphenoxy)ethoxy]ethoxy]ethoxy]propane-1-sulfonate CAS Name: sodium 3-[2-[2-[2-(4-tridecylphenoxy)ethoxy]ethoxy]ethoxy]-1-propanesulfonate IUPAC Name: sodium 3-[2-[2-[2-(4-tridecylphenoxy)ethoxy]ethoxy]ethoxy]propane-1-sulfonate Traditional Name: sodium 3-[2-[2-[2-(4-tridecylphenoxy)ethoxy]ethoxy]ethoxy]propane-1-sulfonate Formula: C28H49NaO7S MolecularWeight: 552.73923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C28H50O7S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-14-27-15-17-28(18-16-27)35-25-24-34-23-22-33-21-20-32-19-13-26-36(29,30)31;/h15-18H,2-14,19-26H2,1H3,(H,29,30,31);/q;+1/p-1