4-octyl-2-(5-octyl-2-oxidanyl-phenyl)sulfonyl-phenol

Systemtic Name: 4-octyl-2-(5-octyl-2-oxidanyl-phenyl)sulfonyl-phenol Openeye Name: 2-(2-hydroxy-5-octyl-phenyl)sulfonyl-4-octyl-phenol CAS Name: 2-(2-hydroxy-5-octylphenyl)sulfonyl-4-octylphenol IUPAC Name: 2-(2-hydroxy-5-octylphenyl)sulfonyl-4-octylphenol Traditional Name: 2-(2-hydroxy-5-octyl-phenyl)sulfonyl-4-octyl-phenol Formula: C28H42O4S MolecularWeight: 474.69568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)O)S(=O)(=O)C2=C(C=CC(=C2)CCCCCCCC)O

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)O)S(=O)(=O)C2=C(C=CC(=C2)CCCCCCCC)O

InChI

InChI=1S/C28H42O4S/c1-3-5-7-9-11-13-15-23-17-19-25(29)27(21-23)33(31,32)28-22-24(18-20-26(28)30)16-14-12-10-8-6-4-2/h17-22,29-30H,3-16H2,1-2H3