[4-[bis[4-(3-methylphenyl)carbonylperoxycarbonyloxycyclohexyl]methyl]cyclohexyl]oxycarbonyl 3-methylbenzenecarboperoxoate

Systemtic Name: [4-[bis[4-(3-methylphenyl)carbonylperoxycarbonyloxycyclohexyl]methyl]cyclohexyl]oxycarbonyl 3-methylbenzenecarboperoxoate Openeye Name: [4-[bis[4-(3-methylbenzoyl)peroxycarbonyloxycyclohexyl]methyl]cyclohexoxy]carbonyl 3-methylbenzenecarboperoxoate CAS Name: 3-methylbenzenecarboperoxoic acid [[4-[bis[4-[[(3-methylphenyl)-oxomethyl]dioxy-oxomethoxy]cyclohexyl]methyl]cyclohexyl]oxy-oxomethyl] ester IUPAC Name: [4-[bis[4-(3-methylbenzoyl)peroxycarbonyloxycyclohexyl]methyl]cyclohexyl]oxycarbonyl 3-methylbenzenecarboperoxoate Traditional Name: 3-methylbenzenecarboperoxoic acid [4-[bis(4-m-toluoylperoxycarbonyloxycyclohexyl)methyl]cyclohexoxy]carbonyl ester Formula: C46H52O15 MolecularWeight: 844.89608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OOC(=O)OC2CCC(CC2)C(C3CCC(CC3)OC(=O)OOC(=O)C4=CC(=CC=C4)C)C5CCC(CC5)OC(=O)OOC(=O)C6=CC(=CC=C6)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OOC(=O)OC2CCC(CC2)C(C3CCC(CC3)OC(=O)OOC(=O)C4=CC(=CC=C4)C)C5CCC(CC5)OC(=O)OOC(=O)C6=CC(=CC=C6)C

InChI

InChI=1S/C46H52O15/c1-28-7-4-10-34(25-28)41(47)56-59-44(50)53-37-19-13-31(14-20-37)40(32-15-21-38(22-16-32)54-45(51)60-57-42(48)35-11-5-8-29(2)26-35)33-17-23-39(24-18-33)55-46(52)61-58-43(49)36-12-6-9-30(3)27-36/h4-12,25-27,31-33,37-40H,13-24H2,1-3H3