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

Systemtic Name: [4-[tris[4-(3-methylphenyl)carbonylperoxycarbonyloxycyclohexyl]methyl]cyclohexyl]oxycarbonyl 3-methylbenzenecarboperoxoate Openeye Name: [4-[tris[4-(3-methylbenzoyl)peroxycarbonyloxycyclohexyl]methyl]cyclohexoxy]carbonyl 3-methylbenzenecarboperoxoate CAS Name: 3-methylbenzenecarboperoxoic acid [oxo-[4-[tris[4-[[(3-methylphenyl)-oxomethyl]dioxy-oxomethoxy]cyclohexyl]methyl]cyclohexyl]oxymethyl] ester IUPAC Name: [4-[tris[4-(3-methylbenzoyl)peroxycarbonyloxycyclohexyl]methyl]cyclohexyl]oxycarbonyl 3-methylbenzenecarboperoxoate Traditional Name: 3-methylbenzenecarboperoxoic acid [4-[tris(4-m-toluoylperoxycarbonyloxycyclohexyl)methyl]cyclohexoxy]carbonyl ester Formula: C61H68O20 MolecularWeight: 1121.18062

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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)C7CCC(CC7)OC(=O)OOC(=O)C8=CC(=CC=C8)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)C7CCC(CC7)OC(=O)OOC(=O)C8=CC(=CC=C8)C

InChI

InChI=1S/C61H68O20/c1-37-9-5-13-41(33-37)53(62)74-78-57(66)70-49-25-17-45(18-26-49)61(46-19-27-50(28-20-46)71-58(67)79-75-54(63)42-14-6-10-38(2)34-42,47-21-29-51(30-22-47)72-59(68)80-76-55(64)43-15-7-11-39(3)35-43)48-23-31-52(32-24-48)73-60(69)81-77-56(65)44-16-8-12-40(4)36-44/h5-16,33-36,45-52H,17-32H2,1-4H3