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

Systemtic Name: 4-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylcyclopropyl]sulfanyl-phenoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylcyclopropyl]sulfanyl-phenoxy]-4-oxo-butanoic acid CAS Name: 4-[2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]cyclopropyl]thio]phenoxy]-4-oxobutanoic acid IUPAC Name: 4-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylcyclopropyl]sulfanylphenoxy]-4-oxobutanoic acid Traditional Name: 4-[2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]cyclopropyl]thio]phenoxy]-4-keto-butyric acid Formula: C35H50O5S2 MolecularWeight: 614.8985

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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)CCC(=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)CCC(=O)O)C(C)(C)C

InChI

InChI=1S/C35H50O5S2/c1-31(2,3)23-17-21(18-24(29(23)39)32(4,5)6)41-35(15-16-35)42-22-19-25(33(7,8)9)30(26(20-22)34(10,11)12)40-28(38)14-13-27(36)37/h17-20,39H,13-16H2,1-12H3,(H,36,37)