2-octanoyloxyicosane-1-sulfonic acid

Systemtic Name: 2-octanoyloxyicosane-1-sulfonic acid Openeye Name: 2-octanoyloxyicosane-1-sulfonic acid CAS Name: 2-(1-oxooctoxy)-1-eicosanesulfonic acid IUPAC Name: 2-octanoyloxyicosane-1-sulfonic acid Traditional Name: 2-caprylyloxyeicosane-1-sulfonic acid Formula: C28H56O5S MolecularWeight: 504.80624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CS(=O)(=O)O)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CS(=O)(=O)O)OC(=O)CCCCCCC

InChI

InChI=1S/C28H56O5S/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-21-22-24-27(26-34(30,31)32)33-28(29)25-23-20-8-6-4-2/h27H,3-26H2,1-2H3,(H,30,31,32)