1-[3-(2-octylphenoxy)octadec-1-en-2-yloxy]ethyl hydrogen sulfate

Systemtic Name: 1-[3-(2-octylphenoxy)octadec-1-en-2-yloxy]ethyl hydrogen sulfate Openeye Name: 1-[1-methylene-2-(2-octylphenoxy)heptadecoxy]ethyl hydrogen sulfate CAS Name: sulfuric acid 1-[3-(2-octylphenoxy)octadec-1-en-2-yloxy]ethyl ester IUPAC Name: 1-[3-(2-octylphenoxy)octadec-1-en-2-yloxy]ethyl hydrogen sulfate Traditional Name: sulfuric acid 1-[1-[1-(2-octylphenoxy)hexadecyl]vinyloxy]ethyl ester Formula: C34H60O6S MolecularWeight: 596.9016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(=C)OC(C)OS(=O)(=O)O)OC1=CC=CC=C1CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(C(=C)OC(C)OS(=O)(=O)O)OC1=CC=CC=C1CCCCCCCC

InChI

InChI=1S/C34H60O6S/c1-5-7-9-11-13-14-15-16-17-18-19-21-23-28-33(30(3)38-31(4)40-41(35,36)37)39-34-29-25-24-27-32(34)26-22-20-12-10-8-6-2/h24-25,27,29,31,33H,3,5-23,26,28H2,1-2,4H3,(H,35,36,37)