O3-tert-butyl O1-ethyl 2-[3-(trifluoromethyl)phenyl]propanedioate

Systemtic Name: O3-tert-butyl O1-ethyl 2-[3-(trifluoromethyl)phenyl]propanedioate Openeye Name: O1-tert-butyl O3-ethyl 2-[3-(trifluoromethyl)phenyl]propanedioate CAS Name: 2-[3-(trifluoromethyl)phenyl]propanedioic acid O3-tert-butyl ester O1-ethyl ester IUPAC Name: 3-O-tert-butyl 1-O-ethyl 2-[3-(trifluoromethyl)phenyl]propanedioate Traditional Name: 2-[3-(trifluoromethyl)phenyl]malonic acid O1-tert-butyl ester O3-ethyl ester Formula: C16H19F3O4 MolecularWeight: 332.31487

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19F3O4/c1-5-22-13(20)12(14(21)23-15(2,3)4)10-7-6-8-11(9-10)16(17,18)19/h6-9,12H,5H2,1-4H3