2-[3-[3-(trifluoromethyl)phenyl]propyl]propanedioic acid

Systemtic Name: 2-[3-[3-(trifluoromethyl)phenyl]propyl]propanedioic acid Openeye Name: 2-[3-[3-(trifluoromethyl)phenyl]propyl]propanedioic acid CAS Name: 2-[3-[3-(trifluoromethyl)phenyl]propyl]propanedioic acid IUPAC Name: 2-[3-[3-(trifluoromethyl)phenyl]propyl]propanedioic acid Traditional Name: 2-[3-[3-(trifluoromethyl)phenyl]propyl]malonic acid Formula: C13H13F3O4 MolecularWeight: 290.23513

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CCCC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CCCC(C(=O)O)C(=O)O

InChI

InChI=1S/C13H13F3O4/c14-13(15,16)9-5-1-3-8(7-9)4-2-6-10(11(17)18)12(19)20/h1,3,5,7,10H,2,4,6H2,(H,17,18)(H,19,20)