2-[4-[3-(trifluoromethyl)phenyl]butyl]propanedioic acid

Systemtic Name: 2-[4-[3-(trifluoromethyl)phenyl]butyl]propanedioic acid Openeye Name: 2-[4-[3-(trifluoromethyl)phenyl]butyl]propanedioic acid CAS Name: 2-[4-[3-(trifluoromethyl)phenyl]butyl]propanedioic acid IUPAC Name: 2-[4-[3-(trifluoromethyl)phenyl]butyl]propanedioic acid Traditional Name: 2-[4-[3-(trifluoromethyl)phenyl]butyl]malonic acid Formula: C14H15F3O4 MolecularWeight: 304.26171

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15F3O4/c15-14(16,17)10-6-3-5-9(8-10)4-1-2-7-11(12(18)19)13(20)21/h3,5-6,8,11H,1-2,4,7H2,(H,18,19)(H,20,21)