2-(6-methylheptyl)-3-[2-(6-methylheptyl)-3-oxidanyl-phenyl]sulfanyl-phenol

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC1=C(C=CC=C1SC2=CC=CC(=C2CCCCCC(C)C)O)O

Isomeric SMILES

CC(C)CCCCCC1=C(C=CC=C1SC2=CC=CC(=C2CCCCCC(C)C)O)O

InChI

InChI=1S/C28H42O2S/c1-21(2)13-7-5-9-15-23-25(29)17-11-19-27(23)31-28-20-12-18-26(30)24(28)16-10-6-8-14-22(3)4/h11-12,17-22,29-30H,5-10,13-16H2,1-4H3