[3-(4-butylphenyl)carbonylperoxycarbonyloxy-2,2-bis[(4-butylphenyl)carbonylperoxycarbonyloxymethyl]propoxy]carbonyl 4-butylbenzenecarboperoxoate

Systemtic Name: [3-(4-butylphenyl)carbonylperoxycarbonyloxy-2,2-bis[(4-butylphenyl)carbonylperoxycarbonyloxymethyl]propoxy]carbonyl 4-butylbenzenecarboperoxoate Openeye Name: [3-(4-butylbenzoyl)peroxycarbonyloxy-2,2-bis[(4-butylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl 4-butylbenzenecarboperoxoate CAS Name: 4-butylbenzenecarboperoxoic acid [[3-[[(4-butylphenyl)-oxomethyl]dioxy-oxomethoxy]-2,2-bis[[[(4-butylphenyl)-oxomethyl]dioxy-oxomethoxy]methyl]propoxy]-oxomethyl] ester IUPAC Name: [3-(4-butylbenzoyl)peroxycarbonyloxy-2,2-bis[(4-butylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl 4-butylbenzenecarboperoxoate Traditional Name: 4-butylbenzenecarboperoxoic acid [3-(4-butylbenzoyl)peroxycarbonyloxy-2,2-bis[(4-butylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl ester Formula: C53H60O20 MolecularWeight: 1017.0315

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OOC(=O)OCC(COC(=O)OOC(=O)C2=CC=C(C=C2)CCCC)(COC(=O)OOC(=O)C3=CC=C(C=C3)CCCC)COC(=O)OOC(=O)C4=CC=C(C=C4)CCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OOC(=O)OCC(COC(=O)OOC(=O)C2=CC=C(C=C2)CCCC)(COC(=O)OOC(=O)C3=CC=C(C=C3)CCCC)COC(=O)OOC(=O)C4=CC=C(C=C4)CCCC

InChI

InChI=1S/C53H60O20/c1-5-9-13-37-17-25-41(26-18-37)45(54)66-70-49(58)62-33-53(34-63-50(59)71-67-46(55)42-27-19-38(20-28-42)14-10-6-2,35-64-51(60)72-68-47(56)43-29-21-39(22-30-43)15-11-7-3)36-65-52(61)73-69-48(57)44-31-23-40(24-32-44)16-12-8-4/h17-32H,5-16,33-36H2,1-4H3