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

Systemtic Name: 2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethylsulfinyl]ethanoic acid Openeye Name: 2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylethylsulfinyl]acetic acid CAS Name: 2-[2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]ethylsulfinyl]acetic acid IUPAC Name: 2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylethylsulfinyl]acetic acid Traditional Name: 2-[2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]ethylsulfinyl]acetic acid Formula: C18H28O4S2 MolecularWeight: 372.54252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCCS(=O)CC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCCS(=O)CC(=O)O

InChI

InChI=1S/C18H28O4S2/c1-17(2,3)13-9-12(10-14(16(13)21)18(4,5)6)23-7-8-24(22)11-15(19)20/h9-10,21H,7-8,11H2,1-6H3,(H,19,20)