2-[2-ethyl-2-methyl-4-[(2-methyl-2-adamantyl)oxy]-4-oxidanylidene-butyl]-2-methyl-butanedioic acid

Systemtic Name: 2-[2-ethyl-2-methyl-4-[(2-methyl-2-adamantyl)oxy]-4-oxidanylidene-butyl]-2-methyl-butanedioic acid Openeye Name: 2-[2-ethyl-2-methyl-4-[(2-methyl-2-adamantyl)oxy]-4-oxo-butyl]-2-methyl-butanedioic acid CAS Name: 2-[2-ethyl-2-methyl-4-[(2-methyl-2-adamantyl)oxy]-4-oxobutyl]-2-methylbutanedioic acid IUPAC Name: 2-[2-ethyl-2-methyl-4-[(2-methyl-2-adamantyl)oxy]-4-oxobutyl]-2-methylbutanedioic acid Traditional Name: 2-[2-ethyl-4-keto-2-methyl-4-[(2-methyl-2-adamantyl)oxy]butyl]-2-methyl-succinic acid Formula: C23H36O6 MolecularWeight: 408.52834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(=O)OC1(C2CC3CC(C2)CC1C3)C)CC(C)(CC(=O)O)C(=O)O

Isomeric SMILES

CCC(C)(CC(=O)OC1(C2CC3CC(C2)CC1C3)C)CC(C)(CC(=O)O)C(=O)O

InChI

InChI=1S/C23H36O6/c1-5-21(2,13-22(3,20(27)28)11-18(24)25)12-19(26)29-23(4)16-7-14-6-15(9-16)10-17(23)8-14/h14-17H,5-13H2,1-4H3,(H,24,25)(H,27,28)