(3-oxidanyl-1-adamantyl) 2-methyl-2-(trifluoromethyl)butanoate

Systemtic Name: (3-oxidanyl-1-adamantyl) 2-methyl-2-(trifluoromethyl)butanoate Openeye Name: (3-hydroxy-1-adamantyl) 2-methyl-2-(trifluoromethyl)butanoate CAS Name: 2-methyl-2-(trifluoromethyl)butanoic acid (3-hydroxy-1-adamantyl) ester IUPAC Name: (3-hydroxy-1-adamantyl) 2-methyl-2-(trifluoromethyl)butanoate Traditional Name: 2-methyl-2-(trifluoromethyl)butyric acid (3-hydroxy-1-adamantyl) ester Formula: C16H23F3O3 MolecularWeight: 320.34723

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OC12CC3CC(C1)CC(C3)(C2)O)C(F)(F)F

Isomeric SMILES

CCC(C)(C(=O)OC12CC3CC(C1)CC(C3)(C2)O)C(F)(F)F

InChI

InChI=1S/C16H23F3O3/c1-3-13(2,16(17,18)19)12(20)22-15-7-10-4-11(8-15)6-14(21,5-10)9-15/h10-11,21H,3-9H2,1-2H3