(E)-1-[(E)-octadec-9-enoxy]-1-oxidanylidene-octadec-9-ene-2-sulfonic acid

Systemtic Name: (E)-1-[(E)-octadec-9-enoxy]-1-oxidanylidene-octadec-9-ene-2-sulfonic acid Openeye Name: (E)-1-[(E)-octadec-9-enoxy]-1-oxo-octadec-9-ene-2-sulfonic acid CAS Name: (E)-1-[(E)-octadec-9-enoxy]-1-oxo-9-octadecene-2-sulfonic acid IUPAC Name: (E)-1-[(E)-octadec-9-enoxy]-1-oxooctadec-9-ene-2-sulfonic acid Traditional Name: (E)-1-keto-1-[(E)-octadec-9-enoxy]octadec-9-ene-2-sulfonic acid Formula: C36H68O5S MolecularWeight: 612.98712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC(=O)C(CCCCCCC=CCCCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC(=O)C(CCCCCC/C=C/CCCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C36H68O5S/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-41-36(37)35(42(38,39)40)33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h17-19,21,35H,3-16,20,22-34H2,1-2H3,(H,38,39,40)/b19-17+,21-18+