3-octyl-2-(2-octyl-6-oxidanyl-phenyl)sulfanyl-phenol

Systemtic Name: 3-octyl-2-(2-octyl-6-oxidanyl-phenyl)sulfanyl-phenol Openeye Name: 2-(2-hydroxy-6-octyl-phenyl)sulfanyl-3-octyl-phenol CAS Name: 2-[(2-hydroxy-6-octylphenyl)thio]-3-octylphenol IUPAC Name: 2-(2-hydroxy-6-octylphenyl)sulfanyl-3-octylphenol Traditional Name: 2-[(2-hydroxy-6-octyl-phenyl)thio]-3-octyl-phenol Formula: C28H42O2S MolecularWeight: 442.69688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=CC=C1)O)SC2=C(C=CC=C2O)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=C(C(=CC=C1)O)SC2=C(C=CC=C2O)CCCCCCCC

InChI

InChI=1S/C28H42O2S/c1-3-5-7-9-11-13-17-23-19-15-21-25(29)27(23)31-28-24(20-16-22-26(28)30)18-14-12-10-8-6-4-2/h15-16,19-22,29-30H,3-14,17-18H2,1-2H3