[4-(4-hydroxyphenyl)sulfonylphenyl] hexadecane-1-sulfonate

Systemtic Name: [4-(4-hydroxyphenyl)sulfonylphenyl] hexadecane-1-sulfonate Openeye Name: [4-(4-hydroxyphenyl)sulfonylphenyl] hexadecane-1-sulfonate CAS Name: 1-hexadecanesulfonic acid IUPAC Name: [4-(4-hydroxyphenyl)sulfonylphenyl] hexadecane-1-sulfonate Traditional Name: hexadecane-1-sulfonic acid [4-(4-hydroxyphenyl)sulfonylphenyl] ester Formula: C28H42O6S2 MolecularWeight: 538.75948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)OC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)OC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C28H42O6S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-35(30,31)34-26-18-22-28(23-19-26)36(32,33)27-20-16-25(29)17-21-27/h16-23,29H,2-15,24H2,1H3