[2-(1-adamantyl)-2-oxidanylidene-ethyl] 4-(1-adamantyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 4-(1-adamantyl)-4-oxidanylidene-butanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 4-(1-adamantyl)-4-oxo-butanoate CAS Name: 4-(1-adamantyl)-4-oxobutanoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 4-(1-adamantyl)-4-oxobutanoate Traditional Name: 4-(1-adamantyl)-4-keto-butyric acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C26H36O4 MolecularWeight: 412.56164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CCC(=O)OCC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CCC(=O)OCC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H36O4/c27-22(25-9-16-3-17(10-25)5-18(4-16)11-25)1-2-24(29)30-15-23(28)26-12-19-6-20(13-26)8-21(7-19)14-26/h16-21H,1-15H2