1-[3,5-bis(trifluoromethyl)phenyl]hex-5-yn-1-one

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]hex-5-yn-1-one Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]hex-5-yn-1-one CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-5-hexyn-1-one IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]hex-5-yn-1-one Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]hex-5-yn-1-one Formula: C14H10F6O MolecularWeight: 308.219019

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10F6O/c1-2-3-4-5-12(21)9-6-10(13(15,16)17)8-11(7-9)14(18,19)20/h1,6-8H,3-5H2