5-[2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropan-2-ylsulfanyl]phenoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropan-2-ylsulfanyl]phenoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-methyl-ethyl]sulfanyl-phenoxy]-5-oxo-pentanoic acid CAS Name: 5-[2,6-ditert-butyl-4-[2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]propan-2-ylthio]phenoxy]-5-oxopentanoic acid IUPAC Name: 5-[2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenoxy]-5-oxopentanoic acid Traditional Name: 5-[2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-1-methyl-ethyl]thio]phenoxy]-5-keto-valeric acid Formula: C36H54O5S2 MolecularWeight: 630.94096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)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)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)OC(=O)CCCC(=O)O)C(C)(C)C

InChI

InChI=1S/C36H54O5S2/c1-32(2,3)24-18-22(19-25(30(24)40)33(4,5)6)42-36(13,14)43-23-20-26(34(7,8)9)31(27(21-23)35(10,11)12)41-29(39)17-15-16-28(37)38/h18-21,40H,15-17H2,1-14H3,(H,37,38)