bis(phenylmethyl) 2-[3,4,4-tris(fluoranyl)but-3-enyl]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[3,4,4-tris(fluoranyl)but-3-enyl]propanedioate Openeye Name: dibenzyl 2-(3,4,4-trifluorobut-3-enyl)propanedioate CAS Name: 2-(3,4,4-trifluorobut-3-enyl)propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-(3,4,4-trifluorobut-3-enyl)propanedioate Traditional Name: 2-(3,4,4-trifluorobut-3-enyl)malonic acid dibenzyl ester Formula: C21H19F3O4 MolecularWeight: 392.36837

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCC(=C(F)F)F)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CCC(=C(F)F)F)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H19F3O4/c22-18(19(23)24)12-11-17(20(25)27-13-15-7-3-1-4-8-15)21(26)28-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2