[2-(acetyloxymethylperoxy)-3-(1-adamantylcarbonyloxy)propyl] adamantane-1-carboxylate

Systemtic Name: [2-(acetyloxymethylperoxy)-3-(1-adamantylcarbonyloxy)propyl] adamantane-1-carboxylate Openeye Name: [2-(acetoxymethylperoxy)-3-(adamantane-1-carbonyloxy)propyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-(acetyloxymethyldioxy)-3-[1-adamantyl(oxo)methoxy]propyl] ester IUPAC Name: [2-(acetyloxymethylperoxy)-3-(adamantane-1-carbonyloxy)propyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-(acetoxymethylperoxy)-3-(adamantane-1-carbonyloxy)propyl] ester Formula: C28H40O8 MolecularWeight: 504.6124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOOC(COC(=O)C12CC3CC(C1)CC(C3)C2)COC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(=O)OCOOC(COC(=O)C12CC3CC(C1)CC(C3)C2)COC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H40O8/c1-17(29)34-16-35-36-24(14-32-25(30)27-8-18-2-19(9-27)4-20(3-18)10-27)15-33-26(31)28-11-21-5-22(12-28)7-23(6-21)13-28/h18-24H,2-16H2,1H3