potassium (2-octadecan-2-yl-4-oxidanyl-phenyl) sulfate

Systemtic Name: potassium (2-octadecan-2-yl-4-oxidanyl-phenyl) sulfate Openeye Name: potassium [4-hydroxy-2-(1-methylheptadecyl)phenyl] sulfate CAS Name: potassium (4-hydroxy-2-octadecan-2-ylphenyl) sulfate IUPAC Name: potassium (4-hydroxy-2-octadecan-2-ylphenyl) sulfate Traditional Name: potassium [4-hydroxy-2-(1-methylheptadecyl)phenyl] sulfate Formula: C24H41KO5S MolecularWeight: 480.74264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)C1=C(C=CC(=C1)O)OS(=O)(=O)[O-].[K+]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)C1=C(C=CC(=C1)O)OS(=O)(=O)[O-].[K+]

InChI

InChI=1S/C24H42O5S.K/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(2)23-20-22(25)18-19-24(23)29-30(26,27)28;/h18-21,25H,3-17H2,1-2H3,(H,26,27,28);/q;+1/p-1