1-(3-bromanyl-2,2-dimethyl-3-oxidanyl-4H-chromen-6-yl)-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-(3-bromanyl-2,2-dimethyl-3-oxidanyl-4H-chromen-6-yl)-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-(3-bromo-3-hydroxy-2,2-dimethyl-chroman-6-yl)-2,2,2-trifluoro-ethanone CAS Name: 1-(3-bromo-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2,2,2-trifluoroethanone IUPAC Name: 1-(3-bromo-3-hydroxy-2,2-dimethyl-4H-chromen-6-yl)-2,2,2-trifluoroethanone Traditional Name: 1-(3-bromo-3-hydroxy-2,2-dimethyl-chroman-6-yl)-2,2,2-trifluoro-ethanone Formula: C13H12BrF3O3 MolecularWeight: 353.13179

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=CC(=C2)C(=O)C(F)(F)F)(O)Br)C

Isomeric SMILES

CC1(C(CC2=C(O1)C=CC(=C2)C(=O)C(F)(F)F)(O)Br)C

InChI

InChI=1S/C13H12BrF3O3/c1-11(2)12(14,19)6-8-5-7(3-4-9(8)20-11)10(18)13(15,16)17/h3-5,19H,6H2,1-2H3