[3-hexadecoxy-2-(2-hydroxyethyloxy)octadecyl] hydrogen sulfate

Systemtic Name: [3-hexadecoxy-2-(2-hydroxyethyloxy)octadecyl] hydrogen sulfate Openeye Name: [3-hexadecoxy-2-(2-hydroxyethoxy)octadecyl] hydrogen sulfate CAS Name: sulfuric acid [3-hexadecoxy-2-(2-hydroxyethoxy)octadecyl] ester IUPAC Name: [3-hexadecoxy-2-(2-hydroxyethoxy)octadecyl] hydrogen sulfate Traditional Name: sulfuric acid [3-cetyloxy-2-(2-hydroxyethoxy)octadecyl] ester Formula: C36H74O7S MolecularWeight: 651.03356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(CCCCCCCCCCCCCCC)C(COS(=O)(=O)O)OCCO

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(CCCCCCCCCCCCCCC)C(COS(=O)(=O)O)OCCO

InChI

InChI=1S/C36H74O7S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-32-41-35(36(42-33-31-37)34-43-44(38,39)40)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-37H,3-34H2,1-2H3,(H,38,39,40)