sodium 1-ethoxy-1-oxidanylidene-hexadecane-2-sulfonic acid

Systemtic Name: sodium 1-ethoxy-1-oxidanylidene-hexadecane-2-sulfonic acid Openeye Name: sodium 1-ethoxy-1-oxo-hexadecane-2-sulfonic acid CAS Name: sodium 1-ethoxy-1-oxo-2-hexadecanesulfonic acid IUPAC Name: sodium 1-ethoxy-1-oxohexadecane-2-sulfonic acid Traditional Name: sodium 1-ethoxy-1-keto-hexadecane-2-sulfonic acid Formula: C18H36NaO5S+ MolecularWeight: 387.53021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(=O)OCC)S(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCC(C(=O)OCC)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C18H36O5S.Na/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(24(20,21)22)18(19)23-4-2;/h17H,3-16H2,1-2H3,(H,20,21,22);/q;+1