diethyl 2-[(E)-4,4,4-tris(fluoranyl)-1-phenyl-but-2-enyl]propanedioate

Systemtic Name: diethyl 2-[(E)-4,4,4-tris(fluoranyl)-1-phenyl-but-2-enyl]propanedioate Openeye Name: diethyl 2-[(E)-4,4,4-trifluoro-1-phenyl-but-2-enyl]propanedioate CAS Name: 2-[(E)-4,4,4-trifluoro-1-phenylbut-2-enyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-4,4,4-trifluoro-1-phenylbut-2-enyl]propanedioate Traditional Name: 2-[(E)-4,4,4-trifluoro-1-phenyl-but-2-enyl]malonic acid diethyl ester Formula: C17H19F3O4 MolecularWeight: 344.32557

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(C(/C=C/C(F)(F)F)C1=CC=CC=C1)C(=O)OCC

InChI

InChI=1S/C17H19F3O4/c1-3-23-15(21)14(16(22)24-4-2)13(10-11-17(18,19)20)12-8-6-5-7-9-12/h5-11,13-14H,3-4H2,1-2H3/b11-10+