2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylbutanoic acid

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylbutanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylbutanoic acid CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]butanoic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylbutanoic acid Traditional Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]butyric acid Formula: C18H28O3S MolecularWeight: 324.47812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28O3S/c1-8-14(16(20)21)22-11-9-12(17(2,3)4)15(19)13(10-11)18(5,6)7/h9-10,14,19H,8H2,1-7H3,(H,20,21)