[(E)-heptadec-1-enyl] (E)-1-oxidanylideneoctadec-2-ene-1-sulfonate

Systemtic Name: [(E)-heptadec-1-enyl] (E)-1-oxidanylideneoctadec-2-ene-1-sulfonate Openeye Name: [(E)-heptadec-1-enyl] (E)-1-oxooctadec-2-ene-1-sulfonate CAS Name: (E)-1-oxo-2-octadecene-1-sulfonic acid [(E)-heptadec-1-enyl] ester IUPAC Name: [(E)-heptadec-1-enyl] (E)-1-oxooctadec-2-ene-1-sulfonate Traditional Name: (E)-1-ketooctadec-2-ene-1-sulfonic acid [(E)-heptadec-1-enyl] ester Formula: C35H66O4S MolecularWeight: 582.96114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC=CC(=O)S(=O)(=O)OC=CCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCC/C=C/C(=O)S(=O)(=O)O/C=C/CCCCCCCCCCCCCCC

InChI

InChI=1S/C35H66O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(36)40(37,38)39-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-34H,3-30H2,1-2H3/b33-31+,34-32+