2,2-bis[(4-butoxyphenyl)carbonylperoxycarbonyloxymethyl]butoxycarbonyl 4-butoxybenzenecarboperoxoate

Systemtic Name: 2,2-bis[(4-butoxyphenyl)carbonylperoxycarbonyloxymethyl]butoxycarbonyl 4-butoxybenzenecarboperoxoate Openeye Name: 2,2-bis[(4-butoxybenzoyl)peroxycarbonyloxymethyl]butoxycarbonyl 4-butoxybenzenecarboperoxoate CAS Name: 4-butoxybenzenecarboperoxoic acid [2,2-bis[[[(4-butoxyphenyl)-oxomethyl]dioxy-oxomethoxy]methyl]butoxy-oxomethyl] ester IUPAC Name: 2,2-bis[(4-butoxybenzoyl)peroxycarbonyloxymethyl]butoxycarbonyl 4-butoxybenzenecarboperoxoate Traditional Name: 4-butoxybenzenecarboperoxoic acid 2,2-bis[(4-butoxybenzoyl)peroxycarbonyloxymethyl]butoxycarbonyl ester Formula: C42H50O18 MolecularWeight: 842.8356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OOC(=O)OCC(CC)(COC(=O)OOC(=O)C2=CC=C(C=C2)OCCCC)COC(=O)OOC(=O)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OOC(=O)OCC(CC)(COC(=O)OOC(=O)C2=CC=C(C=C2)OCCCC)COC(=O)OOC(=O)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C42H50O18/c1-5-9-24-49-33-18-12-30(13-19-33)36(43)55-58-39(46)52-27-42(8-4,28-53-40(47)59-56-37(44)31-14-20-34(21-15-31)50-25-10-6-2)29-54-41(48)60-57-38(45)32-16-22-35(23-17-32)51-26-11-7-3/h12-23H,5-11,24-29H2,1-4H3