10,11-bis(oxidanyl)-9-sulfo-octadecaneperoxoic acid

Systemtic Name: 10,11-bis(oxidanyl)-9-sulfo-octadecaneperoxoic acid Openeye Name: 10,11-dihydroxy-9-sulfo-octadecaneperoxoic acid CAS Name: 10,11-dihydroxy-9-sulfooctadecaneperoxoic acid IUPAC Name: 10,11-dihydroxy-9-sulfooctadecaneperoxoic acid Traditional Name: 10,11-dihydroxy-9-sulfo-peroxystearic acid Formula: C18H36O8S MolecularWeight: 412.53864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(C(CCCCCCCC(=O)OO)S(=O)(=O)O)O)O

Isomeric SMILES

CCCCCCCC(C(C(CCCCCCCC(=O)OO)S(=O)(=O)O)O)O

InChI

InChI=1S/C18H36O8S/c1-2-3-4-6-9-12-15(19)18(21)16(27(23,24)25)13-10-7-5-8-11-14-17(20)26-22/h15-16,18-19,21-22H,2-14H2,1H3,(H,23,24,25)