2-[[2-(trifluoromethyl)phenyl]methyl]propanedioate

Systemtic Name: 2-[[2-(trifluoromethyl)phenyl]methyl]propanedioate Openeye Name: 2-[[2-(trifluoromethyl)phenyl]methyl]propanedioate CAS Name: 2-[[2-(trifluoromethyl)phenyl]methyl]propanedioate IUPAC Name: 2-[[2-(trifluoromethyl)phenyl]methyl]propanedioate Traditional Name: 2-[2-(trifluoromethyl)benzyl]malonate Formula: C11H7F3O4-2 MolecularWeight: 260.16609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(C(=O)[O-])C(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CC(C(=O)[O-])C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C11H9F3O4/c12-11(13,14)8-4-2-1-3-6(8)5-7(9(15)16)10(17)18/h1-4,7H,5H2,(H,15,16)(H,17,18)/p-2