[3-(3-methylphenyl)carbonylperoxycarbonyloxy-2,2-bis[(3-methylphenyl)carbonylperoxycarbonyloxymethyl]propoxy]carbonyl 3-methylbenzenecarboperoxoate

Systemtic Name: [3-(3-methylphenyl)carbonylperoxycarbonyloxy-2,2-bis[(3-methylphenyl)carbonylperoxycarbonyloxymethyl]propoxy]carbonyl 3-methylbenzenecarboperoxoate Openeye Name: [3-(3-methylbenzoyl)peroxycarbonyloxy-2,2-bis[(3-methylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl 3-methylbenzenecarboperoxoate CAS Name: 3-methylbenzenecarboperoxoic acid [[3-[[(3-methylphenyl)-oxomethyl]dioxy-oxomethoxy]-2,2-bis[[[(3-methylphenyl)-oxomethyl]dioxy-oxomethoxy]methyl]propoxy]-oxomethyl] ester IUPAC Name: [3-(3-methylbenzoyl)peroxycarbonyloxy-2,2-bis[(3-methylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl 3-methylbenzenecarboperoxoate Traditional Name: 3-methylbenzenecarboperoxoic acid [3-m-toluoylperoxycarbonyloxy-2,2-bis(m-toluoylperoxycarbonyloxymethyl)propoxy]carbonyl ester Formula: C41H36O20 MolecularWeight: 848.71254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OOC(=O)OCC(COC(=O)OOC(=O)C2=CC(=CC=C2)C)(COC(=O)OOC(=O)C3=CC(=CC=C3)C)COC(=O)OOC(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OOC(=O)OCC(COC(=O)OOC(=O)C2=CC(=CC=C2)C)(COC(=O)OOC(=O)C3=CC(=CC=C3)C)COC(=O)OOC(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C41H36O20/c1-25-9-5-13-29(17-25)33(42)54-58-37(46)50-21-41(22-51-38(47)59-55-34(43)30-14-6-10-26(2)18-30,23-52-39(48)60-56-35(44)31-15-7-11-27(3)19-31)24-53-40(49)61-57-36(45)32-16-8-12-28(4)20-32/h5-20H,21-24H2,1-4H3