1-acetyloxyhexacosane-1-sulfonic acid

Systemtic Name: 1-acetyloxyhexacosane-1-sulfonic acid Openeye Name: 1-acetoxyhexacosane-1-sulfonic acid CAS Name: 1-acetyloxy-1-hexacosanesulfonic acid IUPAC Name: 1-acetyloxyhexacosane-1-sulfonic acid Traditional Name: 1-acetoxyhexacosane-1-sulfonic acid Formula: C28H56O5S MolecularWeight: 504.80624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCC(OC(=O)C)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC(OC(=O)C)S(=O)(=O)O

InChI

InChI=1S/C28H56O5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28(33-27(2)29)34(30,31)32/h28H,3-26H2,1-2H3,(H,30,31,32)