8-oxidanylidene-8-[3-(trifluoromethyl)phenyl]octanoic acid

Systemtic Name: 8-oxidanylidene-8-[3-(trifluoromethyl)phenyl]octanoic acid Openeye Name: 8-oxo-8-[3-(trifluoromethyl)phenyl]octanoic acid CAS Name: 8-oxo-8-[3-(trifluoromethyl)phenyl]octanoic acid IUPAC Name: 8-oxo-8-[3-(trifluoromethyl)phenyl]octanoic acid Traditional Name: 8-keto-8-[3-(trifluoromethyl)phenyl]caprylic acid Formula: C15H17F3O3 MolecularWeight: 302.28889

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17F3O3/c16-15(17,18)12-7-5-6-11(10-12)13(19)8-3-1-2-4-9-14(20)21/h5-7,10H,1-4,8-9H2,(H,20,21)