bis(2,4,4-trimethylpentan-2-yl) 4-[3,4-bis(2,4,4-trimethylpentan-2-ylperoxycarbonyl)phenyl]carbonylbenzene-1,2-dicarboperoxoate

Systemtic Name: bis(2,4,4-trimethylpentan-2-yl) 4-[3,4-bis(2,4,4-trimethylpentan-2-ylperoxycarbonyl)phenyl]carbonylbenzene-1,2-dicarboperoxoate Openeye Name: bis(1,1,3,3-tetramethylbutyl) 4-[3,4-bis(1,1,3,3-tetramethylbutylperoxycarbonyl)benzoyl]benzene-1,2-dicarboperoxoate CAS Name: 4-[[3,4-bis[oxo(2,4,4-trimethylpentan-2-yldioxy)methyl]phenyl]-oxomethyl]benzene-1,2-dicarboperoxoic acid bis(2,4,4-trimethylpentan-2-yl) ester IUPAC Name: bis(2,4,4-trimethylpentan-2-yl) 4-[3,4-bis(2,4,4-trimethylpentan-2-ylperoxycarbonyl)benzoyl]benzene-1,2-dicarboperoxoate Traditional Name: 4-[3,4-bis(1,1,3,3-tetramethylbutylperoxycarbonyl)benzoyl]benzene-1,2-dicarboperoxoic acid bis(1,1,3,3-tetramethylbutyl) ester Formula: C49H74O13 MolecularWeight: 871.10406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)OOC(=O)C1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)C(=O)OOC(C)(C)CC(C)(C)C)C(=O)OOC(C)(C)CC(C)(C)C)C(=O)OOC(C)(C)CC(C)(C)C

Isomeric SMILES

CC(C)(C)CC(C)(C)OOC(=O)C1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)C(=O)OOC(C)(C)CC(C)(C)C)C(=O)OOC(C)(C)CC(C)(C)C)C(=O)OOC(C)(C)CC(C)(C)C

InChI

InChI=1S/C49H74O13/c1-42(2,3)27-46(13,14)59-55-38(51)33-23-21-31(25-35(33)40(53)57-61-48(17,18)29-44(7,8)9)37(50)32-22-24-34(39(52)56-60-47(15,16)28-43(4,5)6)36(26-32)41(54)58-62-49(19,20)30-45(10,11)12/h21-26H,27-30H2,1-20H3