bis(1-adamantyl) 2,4-dimethyl-3-oxidanylidene-pentanedioate

Systemtic Name: bis(1-adamantyl) 2,4-dimethyl-3-oxidanylidene-pentanedioate Openeye Name: bis(1-adamantyl) 2,4-dimethyl-3-oxo-pentanedioate CAS Name: 2,4-dimethyl-3-oxopentanedioic acid bis(1-adamantyl) ester IUPAC Name: bis(1-adamantyl) 2,4-dimethyl-3-oxopentanedioate Traditional Name: 3-keto-2,4-dimethyl-glutaric acid bis(1-adamantyl) ester Formula: C27H38O5 MolecularWeight: 442.58762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C)C(=O)OC12CC3CC(C1)CC(C3)C2)C(=O)OC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(C(=O)C(C)C(=O)OC12CC3CC(C1)CC(C3)C2)C(=O)OC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H38O5/c1-15(24(29)31-26-9-17-3-18(10-26)5-19(4-17)11-26)23(28)16(2)25(30)32-27-12-20-6-21(13-27)8-22(7-20)14-27/h15-22H,3-14H2,1-2H3