4-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylsulfanyl]-5-methyl-hexan-2-one

Systemtic Name: 4-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylsulfanyl]-5-methyl-hexan-2-one Openeye Name: 4-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylsulfanyl]-5-methyl-hexan-2-one CAS Name: 4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylthio]-5-methyl-2-hexanone IUPAC Name: 4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanyl]-5-methylhexan-2-one Traditional Name: 4-[(3,5-ditert-butyl-4-hydroxy-benzyl)thio]-5-methyl-hexan-2-one Formula: C22H36O2S MolecularWeight: 364.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)C)SCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)C(CC(=O)C)SCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C22H36O2S/c1-14(2)19(10-15(3)23)25-13-16-11-17(21(4,5)6)20(24)18(12-16)22(7,8)9/h11-12,14,19,24H,10,13H2,1-9H3