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

Systemtic Name: [3-(1-adamantylcarbonyloxy)-2-(propanoyloxymethoxy)propyl] adamantane-1-carboxylate Openeye Name: [3-(adamantane-1-carbonyloxy)-2-(propanoyloxymethoxy)propyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [3-[1-adamantyl(oxo)methoxy]-2-(1-oxopropoxymethoxy)propyl] ester IUPAC Name: [3-(adamantane-1-carbonyloxy)-2-(propanoyloxymethoxy)propyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [3-(adamantane-1-carbonyloxy)-2-(propionyloxymethoxy)propyl] ester Formula: C29H42O7 MolecularWeight: 502.63958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H42O7/c1-2-25(30)36-17-35-24(15-33-26(31)28-9-18-3-19(10-28)5-20(4-18)11-28)16-34-27(32)29-12-21-6-22(13-29)8-23(7-21)14-29/h18-24H,2-17H2,1H3