(E)-1-oxidanylidene-1-propoxy-octadec-9-ene-2-sulfonic acid

Systemtic Name: (E)-1-oxidanylidene-1-propoxy-octadec-9-ene-2-sulfonic acid Openeye Name: (E)-1-oxo-1-propoxy-octadec-9-ene-2-sulfonic acid CAS Name: (E)-1-oxo-1-propoxy-9-octadecene-2-sulfonic acid IUPAC Name: (E)-1-oxo-1-propoxyoctadec-9-ene-2-sulfonic acid Traditional Name: (E)-1-keto-1-propoxy-octadec-9-ene-2-sulfonic acid Formula: C21H40O5S MolecularWeight: 404.6043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(C(=O)OCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCC(C(=O)OCCC)S(=O)(=O)O

InChI

InChI=1S/C21H40O5S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(27(23,24)25)21(22)26-19-4-2/h11-12,20H,3-10,13-19H2,1-2H3,(H,23,24,25)/b12-11+