1-[4-(3-bromanylpropoxy)-2-oxidanyl-3-propyl-phenyl]-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-[4-(3-bromanylpropoxy)-2-oxidanyl-3-propyl-phenyl]-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[4-(3-bromopropoxy)-2-hydroxy-3-propyl-phenyl]-2,2,2-trifluoro-ethanone CAS Name: 1-[4-(3-bromopropoxy)-2-hydroxy-3-propylphenyl]-2,2,2-trifluoroethanone IUPAC Name: 1-[4-(3-bromopropoxy)-2-hydroxy-3-propylphenyl]-2,2,2-trifluoroethanone Traditional Name: 1-[4-(3-bromopropoxy)-2-hydroxy-3-propyl-phenyl]-2,2,2-trifluoro-ethanone Formula: C14H16BrF3O3 MolecularWeight: 369.17425

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C(F)(F)F)OCCCBr

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C(F)(F)F)OCCCBr

InChI

InChI=1S/C14H16BrF3O3/c1-2-4-9-11(21-8-3-7-15)6-5-10(12(9)19)13(20)14(16,17)18/h5-6,19H,2-4,7-8H2,1H3