sodium 2-(4-dodecylphenoxy)ethanoate

Systemtic Name: sodium 2-(4-dodecylphenoxy)ethanoate Openeye Name: sodium 2-(4-dodecylphenoxy)acetate CAS Name: sodium 2-(4-dodecylphenoxy)acetate IUPAC Name: sodium 2-(4-dodecylphenoxy)acetate Traditional Name: sodium 2-(4-laurylphenoxy)acetate Formula: C20H31NaO3 MolecularWeight: 342.44811

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)OCC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)OCC(=O)[O-].[Na+]

InChI

InChI=1S/C20H32O3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-17-20(21)22;/h13-16H,2-12,17H2,1H3,(H,21,22);/q;+1/p-1