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5-[2-[4-(trifluoromethyl)phenyl]sulfanylethyl]cyclohexane-1,3-dione

5-[2-[4-(trifluoromethyl)phenyl]sulfanylethyl]cyclohexane-1,3-dione

Systemtic Name:5-[2-[4-(trifluoromethyl)phenyl]sulfanylethyl]cyclohexane-1,3-dione
Openeye Name:5-[2-[4-(trifluoromethyl)phenyl]sulfanylethyl]cyclohexane-1,3-dione
CAS Name:5-[2-[[4-(trifluoromethyl)phenyl]thio]ethyl]cyclohexane-1,3-dione
IUPAC Name:5-[2-[4-(trifluoromethyl)phenyl]sulfanylethyl]cyclohexane-1,3-dione
Traditional Name:5-[2-[[4-(trifluoromethyl)phenyl]thio]ethyl]cyclohexane-1,3-quinone
Formula: C15H15F3O2S
MolecularWeight: 316.33861
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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)CC1=O)CCSC2=CC=C(C=C2)C(F)(F)F


Isomeric SMILES

C1C(CC(=O)CC1=O)CCSC2=CC=C(C=C2)C(F)(F)F


InChI

InChI=1S/C15H15F3O2S/c16-15(17,18)11-1-3-14(4-2-11)21-6-5-10-7-12(19)9-13(20)8-10/h1-4,10H,5-9H2


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