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

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

Systemtic Name:2-oxidanylidene-8-[3-(trifluoromethyl)phenyl]octanoic acid
Openeye Name:2-oxo-8-[3-(trifluoromethyl)phenyl]octanoic acid
CAS Name:2-oxo-8-[3-(trifluoromethyl)phenyl]octanoic acid
IUPAC Name:2-oxo-8-[3-(trifluoromethyl)phenyl]octanoic acid
Traditional Name:2-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)CCCCCCC(=O)C(=O)O


Isomeric SMILES

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


InChI

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


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