sodium 2-(2-ethoxyethoxy)-1-(4-octylphenyl)ethanesulfonate

Systemtic Name: sodium 2-(2-ethoxyethoxy)-1-(4-octylphenyl)ethanesulfonate Openeye Name: sodium 2-(2-ethoxyethoxy)-1-(4-octylphenyl)ethanesulfonate CAS Name: sodium 2-(2-ethoxyethoxy)-1-(4-octylphenyl)ethanesulfonate IUPAC Name: sodium 2-(2-ethoxyethoxy)-1-(4-octylphenyl)ethanesulfonate Traditional Name: sodium 2-(2-ethoxyethoxy)-1-(4-octylphenyl)ethanesulfonate Formula: C20H33NaO5S MolecularWeight: 408.52779

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(COCCOCC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(COCCOCC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H34O5S.Na/c1-3-5-6-7-8-9-10-18-11-13-19(14-12-18)20(26(21,22)23)17-25-16-15-24-4-2;/h11-14,20H,3-10,15-17H2,1-2H3,(H,21,22,23);/q;+1/p-1