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

Systemtic Name: [4-(4-hydroxyphenyl)sulfonylphenyl] decane-1-sulfonate Openeye Name: [4-(4-hydroxyphenyl)sulfonylphenyl] decane-1-sulfonate CAS Name: 1-decanesulfonic acid IUPAC Name: [4-(4-hydroxyphenyl)sulfonylphenyl] decane-1-sulfonate Traditional Name: decane-1-sulfonic acid [4-(4-hydroxyphenyl)sulfonylphenyl] ester Formula: C22H30O6S2 MolecularWeight: 454.6

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30O6S2/c1-2-3-4-5-6-7-8-9-18-29(24,25)28-20-12-16-22(17-13-20)30(26,27)21-14-10-19(23)11-15-21/h10-17,23H,2-9,18H2,1H3