5-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylcyclopropyl]sulfanyl-phenoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylcyclopropyl]sulfanyl-phenoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylcyclopropyl]sulfanyl-phenoxy]-5-oxo-pentanoic acid CAS Name: 5-[2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]cyclopropyl]thio]phenoxy]-5-oxopentanoic acid IUPAC Name: 5-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylcyclopropyl]sulfanylphenoxy]-5-oxopentanoic acid Traditional Name: 5-[2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]cyclopropyl]thio]phenoxy]-5-keto-valeric acid Formula: C36H52O5S2 MolecularWeight: 628.92508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2(CC2)SC3=CC(=C(C(=C3)C(C)(C)C)OC(=O)CCCC(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2(CC2)SC3=CC(=C(C(=C3)C(C)(C)C)OC(=O)CCCC(=O)O)C(C)(C)C

InChI

InChI=1S/C36H52O5S2/c1-32(2,3)24-18-22(19-25(30(24)40)33(4,5)6)42-36(16-17-36)43-23-20-26(34(7,8)9)31(27(21-23)35(10,11)12)41-29(39)15-13-14-28(37)38/h18-21,40H,13-17H2,1-12H3,(H,37,38)