4-ethyl-2,2,4-trimethyl-6-[(2-methyl-2-adamantyl)oxy]-6-oxidanylidene-hexanoic acid

Systemtic Name: 4-ethyl-2,2,4-trimethyl-6-[(2-methyl-2-adamantyl)oxy]-6-oxidanylidene-hexanoic acid Openeye Name: 4-ethyl-2,2,4-trimethyl-6-[(2-methyl-2-adamantyl)oxy]-6-oxo-hexanoic acid CAS Name: 4-ethyl-2,2,4-trimethyl-6-[(2-methyl-2-adamantyl)oxy]-6-oxohexanoic acid IUPAC Name: 4-ethyl-2,2,4-trimethyl-6-[(2-methyl-2-adamantyl)oxy]-6-oxohexanoic acid Traditional Name: 4-ethyl-6-keto-2,2,4-trimethyl-6-[(2-methyl-2-adamantyl)oxy]hexanoic acid Formula: C22H36O4 MolecularWeight: 364.51884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36O4/c1-6-21(4,13-20(2,3)19(24)25)12-18(23)26-22(5)16-8-14-7-15(10-16)11-17(22)9-14/h14-17H,6-13H2,1-5H3,(H,24,25)