2,2-bis[(4-butylphenyl)carbonylperoxycarbonyloxymethyl]butoxycarbonyl 4-butylbenzenecarboperoxoate

Systemtic Name: 2,2-bis[(4-butylphenyl)carbonylperoxycarbonyloxymethyl]butoxycarbonyl 4-butylbenzenecarboperoxoate Openeye Name: 2,2-bis[(4-butylbenzoyl)peroxycarbonyloxymethyl]butoxycarbonyl 4-butylbenzenecarboperoxoate CAS Name: 4-butylbenzenecarboperoxoic acid [2,2-bis[[[(4-butylphenyl)-oxomethyl]dioxy-oxomethoxy]methyl]butoxy-oxomethyl] ester IUPAC Name: 2,2-bis[(4-butylbenzoyl)peroxycarbonyloxymethyl]butoxycarbonyl 4-butylbenzenecarboperoxoate Traditional Name: 4-butylbenzenecarboperoxoic acid 2,2-bis[(4-butylbenzoyl)peroxycarbonyloxymethyl]butoxycarbonyl ester Formula: C42H50O15 MolecularWeight: 794.8374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C42H50O15/c1-5-9-12-30-15-21-33(22-16-30)36(43)52-55-39(46)49-27-42(8-4,28-50-40(47)56-53-37(44)34-23-17-31(18-24-34)13-10-6-2)29-51-41(48)57-54-38(45)35-25-19-32(20-26-35)14-11-7-3/h15-26H,5-14,27-29H2,1-4H3