ditert-butyl (1R,4R)-4-(furan-2-ylcarbonyl)-3-(trifluoromethyl)cyclobut-2-ene-1,2-dicarboxylate

Systemtic Name: ditert-butyl (1R,4R)-4-(furan-2-ylcarbonyl)-3-(trifluoromethyl)cyclobut-2-ene-1,2-dicarboxylate Openeye Name: ditert-butyl (1R,4R)-4-(furan-2-carbonyl)-3-(trifluoromethyl)cyclobut-2-ene-1,2-dicarboxylate CAS Name: (1R,4R)-4-[2-furanyl(oxo)methyl]-3-(trifluoromethyl)cyclobut-2-ene-1,2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (1R,4R)-4-(furan-2-carbonyl)-3-(trifluoromethyl)cyclobut-2-ene-1,2-dicarboxylate Traditional Name: (1R,4R)-4-(2-furoyl)-3-(trifluoromethyl)cyclobut-2-ene-1,2-dicarboxylic acid ditert-butyl ester Formula: C20H23F3O6 MolecularWeight: 416.38823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(C(=C1C(=O)OC(C)(C)C)C(F)(F)F)C(=O)C2=CC=CO2

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1[C@H](C(=C1C(=O)OC(C)(C)C)C(F)(F)F)C(=O)C2=CC=CO2

InChI

InChI=1S/C20H23F3O6/c1-18(2,3)28-16(25)11-12(15(24)10-8-7-9-27-10)14(20(21,22)23)13(11)17(26)29-19(4,5)6/h7-9,11-12H,1-6H3/t11-,12-/m1/s1