dibutyl 2-[2-(1-adamantyl)-2-oxidanylidene-ethyl]propanedioate

Systemtic Name: dibutyl 2-[2-(1-adamantyl)-2-oxidanylidene-ethyl]propanedioate Openeye Name: dibutyl 2-[2-(1-adamantyl)-2-oxo-ethyl]propanedioate CAS Name: 2-[2-(1-adamantyl)-2-oxoethyl]propanedioic acid dibutyl ester IUPAC Name: dibutyl 2-[2-(1-adamantyl)-2-oxoethyl]propanedioate Traditional Name: 2-[2-(1-adamantyl)-2-keto-ethyl]malonic acid dibutyl ester Formula: C23H36O5 MolecularWeight: 392.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC(=O)C12CC3CC(C1)CC(C3)C2)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)C(CC(=O)C12CC3CC(C1)CC(C3)C2)C(=O)OCCCC

InChI

InChI=1S/C23H36O5/c1-3-5-7-27-21(25)19(22(26)28-8-6-4-2)12-20(24)23-13-16-9-17(14-23)11-18(10-16)15-23/h16-19H,3-15H2,1-2H3