[2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropan-2-ylsulfanyl]phenyl] pentanoate

Systemtic Name: [2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropan-2-ylsulfanyl]phenyl] pentanoate Openeye Name: [2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-methyl-ethyl]sulfanyl-phenyl] pentanoate CAS Name: pentanoic acid [2,6-ditert-butyl-4-[2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]propan-2-ylthio]phenyl] ester IUPAC Name: [2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenyl] pentanoate Traditional Name: valeric acid [2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-1-methyl-ethyl]thio]phenyl] ester Formula: C36H56O3S2 MolecularWeight: 600.95804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=C(C=C(C=C1C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCC(=O)OC1=C(C=C(C=C1C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C36H56O3S2/c1-16-17-18-29(37)39-31-27(34(8,9)10)21-24(22-28(31)35(11,12)13)41-36(14,15)40-23-19-25(32(2,3)4)30(38)26(20-23)33(5,6)7/h19-22,38H,16-18H2,1-15H3