8-[3-(2-sulfooctyl)oxiran-2-yl]octaneperoxoic acid

Systemtic Name: 8-[3-(2-sulfooctyl)oxiran-2-yl]octaneperoxoic acid Openeye Name: 8-[3-(2-sulfooctyl)oxiran-2-yl]octaneperoxoic acid CAS Name: 8-[3-(2-sulfooctyl)-2-oxiranyl]octaneperoxoic acid IUPAC Name: 8-[3-(2-sulfooctyl)oxiran-2-yl]octaneperoxoic acid Traditional Name: 8-[3-(2-sulfooctyl)oxiran-2-yl]peroxycaprylic acid Formula: C18H34O7S MolecularWeight: 394.52336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC1C(O1)CCCCCCCC(=O)OO)S(=O)(=O)O

Isomeric SMILES

CCCCCCC(CC1C(O1)CCCCCCCC(=O)OO)S(=O)(=O)O

InChI

InChI=1S/C18H34O7S/c1-2-3-4-8-11-15(26(21,22)23)14-17-16(24-17)12-9-6-5-7-10-13-18(19)25-20/h15-17,20H,2-14H2,1H3,(H,21,22,23)