1-[3-methyl-4-oxidanyl-5-(trifluoromethyl)phenyl]hex-5-yn-1-one

Systemtic Name: 1-[3-methyl-4-oxidanyl-5-(trifluoromethyl)phenyl]hex-5-yn-1-one Openeye Name: 1-[4-hydroxy-3-methyl-5-(trifluoromethyl)phenyl]hex-5-yn-1-one CAS Name: 1-[4-hydroxy-3-methyl-5-(trifluoromethyl)phenyl]-5-hexyn-1-one IUPAC Name: 1-[4-hydroxy-3-methyl-5-(trifluoromethyl)phenyl]hex-5-yn-1-one Traditional Name: 1-[4-hydroxy-3-methyl-5-(trifluoromethyl)phenyl]hex-5-yn-1-one Formula: C14H13F3O2 MolecularWeight: 270.24703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13F3O2/c1-3-4-5-6-12(18)10-7-9(2)13(19)11(8-10)14(15,16)17/h1,7-8,19H,4-6H2,2H3