[5-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoylperoxy]-2,5-dimethyl-hex-3-yn-2-yl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propaneperoxoate

Systemtic Name: [5-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoylperoxy]-2,5-dimethyl-hex-3-yn-2-yl] 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propaneperoxoate Openeye Name: [4-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoylperoxy]-1,1,4-trimethyl-pent-2-ynyl] 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propaneperoxoate CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propaneperoxoic acid [5-[3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxopropyl]dioxy-2,5-dimethylhex-3-yn-2-yl] ester IUPAC Name: [5-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoylperoxy]-2,5-dimethylhex-3-yn-2-yl] 3-(3,5-ditert-butyl-4-hydroxyphenyl)propaneperoxoate Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)peroxypropionic acid [4-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoylperoxy]-1,1,4-trimethyl-pent-2-ynyl] ester Formula: C42H62O8 MolecularWeight: 694.93688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OOC(C)(C)C#CC(C)(C)OOC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OOC(C)(C)C#CC(C)(C)OOC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C42H62O8/c1-37(2,3)29-23-27(24-30(35(29)45)38(4,5)6)17-19-33(43)47-49-41(13,14)21-22-42(15,16)50-48-34(44)20-18-28-25-31(39(7,8)9)36(46)32(26-28)40(10,11)12/h23-26,45-46H,17-20H2,1-16H3