ditert-butyl 2-[4-ethoxycarbonyl-2,3,6-tris(fluoranyl)phenyl]cyclopropane-1,1-dicarboxylate

Systemtic Name: ditert-butyl 2-[4-ethoxycarbonyl-2,3,6-tris(fluoranyl)phenyl]cyclopropane-1,1-dicarboxylate Openeye Name: ditert-butyl 2-(4-ethoxycarbonyl-2,3,6-trifluoro-phenyl)cyclopropane-1,1-dicarboxylate CAS Name: 2-(4-ethoxycarbonyl-2,3,6-trifluorophenyl)cyclopropane-1,1-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-(4-ethoxycarbonyl-2,3,6-trifluorophenyl)cyclopropane-1,1-dicarboxylate Traditional Name: 2-(4-carbethoxy-2,3,6-trifluoro-phenyl)cyclopropane-1,1-dicarboxylic acid ditert-butyl ester Formula: C22H27F3O6 MolecularWeight: 444.44139

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1F)F)C2CC2(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)F

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1F)F)C2CC2(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)F

InChI

InChI=1S/C22H27F3O6/c1-8-29-17(26)11-9-13(23)14(16(25)15(11)24)12-10-22(12,18(27)30-20(2,3)4)19(28)31-21(5,6)7/h9,12H,8,10H2,1-7H3