2-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethylsulfanyl]ethanoic acid

Systemtic Name: 2-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethylsulfanyl]ethanoic acid Openeye Name: 2-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylethylsulfanyl]acetic acid CAS Name: 2-[1-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]ethylthio]acetic acid IUPAC Name: 2-[1-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylethylsulfanyl]acetic acid Traditional Name: 2-[1-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]ethylthio]acetic acid Formula: C18H28O3S2 MolecularWeight: 356.54312

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Descriptors Computed from Structure

Canonical SMILES:

CC(SCC(=O)O)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(SCC(=O)O)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C18H28O3S2/c1-11(22-10-15(19)20)23-12-8-13(17(2,3)4)16(21)14(9-12)18(5,6)7/h8-9,11,21H,10H2,1-7H3,(H,19,20)