5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-oxidanyl-1-oxidanylidene-pentan-2-yl]sulfanyl-pentanoic acid

Systemtic Name: 5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-oxidanyl-1-oxidanylidene-pentan-2-yl]sulfanyl-pentanoic acid Openeye Name: 2-[1-carboxy-4-(3,5-ditert-butyl-4-hydroxy-phenyl)butyl]sulfanyl-5-(3,5-ditert-butyl-4-hydroxy-phenyl)pentanoic acid CAS Name: 5-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[[5-(3,5-ditert-butyl-4-hydroxyphenyl)-1-hydroxy-1-oxopentan-2-yl]thio]pentanoic acid IUPAC Name: 5-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[5-(3,5-ditert-butyl-4-hydroxyphenyl)-1-hydroxy-1-oxopentan-2-yl]sulfanylpentanoic acid Traditional Name: 2-[[1-carboxy-4-(3,5-ditert-butyl-4-hydroxy-phenyl)butyl]thio]-5-(3,5-ditert-butyl-4-hydroxy-phenyl)valeric acid Formula: C38H58O6S MolecularWeight: 642.92852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC(C(=O)O)SC(CCCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC(C(=O)O)SC(CCCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C38H58O6S/c1-35(2,3)25-19-23(20-26(31(25)39)36(4,5)6)15-13-17-29(33(41)42)45-30(34(43)44)18-14-16-24-21-27(37(7,8)9)32(40)28(22-24)38(10,11)12/h19-22,29-30,39-40H,13-18H2,1-12H3,(H,41,42)(H,43,44)