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

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-dodecylsulfanyl-ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-dodecylsulfanyl-acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(dodecylthio)acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-dodecylsulfanylacetic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(laurylthio)acetic acid Formula: C28H48O3S MolecularWeight: 464.74392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCSC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C28H48O3S/c1-8-9-10-11-12-13-14-15-16-17-18-32-25(26(30)31)21-19-22(27(2,3)4)24(29)23(20-21)28(5,6)7/h19-20,25,29H,8-18H2,1-7H3,(H,30,31)