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methyl 6-[3-fluoranyl-5-(trifluoromethyl)phenyl]hex-5-ynoate

methyl 6-[3-fluoranyl-5-(trifluoromethyl)phenyl]hex-5-ynoate

Systemtic Name:methyl 6-[3-fluoranyl-5-(trifluoromethyl)phenyl]hex-5-ynoate
Openeye Name:methyl 6-[3-fluoro-5-(trifluoromethyl)phenyl]hex-5-ynoate
CAS Name:6-[3-fluoro-5-(trifluoromethyl)phenyl]-5-hexynoic acid methyl ester
IUPAC Name:methyl 6-[3-fluoro-5-(trifluoromethyl)phenyl]hex-5-ynoate
Traditional Name:6-[3-fluoro-5-(trifluoromethyl)phenyl]hex-5-ynoic acid methyl ester
Formula: C14H12F4O2
MolecularWeight: 288.237493
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC#CC1=CC(=CC(=C1)F)C(F)(F)F


Isomeric SMILES

COC(=O)CCCC#CC1=CC(=CC(=C1)F)C(F)(F)F


InChI

InChI=1S/C14H12F4O2/c1-20-13(19)6-4-2-3-5-10-7-11(14(16,17)18)9-12(15)8-10/h7-9H,2,4,6H2,1H3


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