[6-(trifluoromethylsulfonyloxy)-3,4-dihydro-1H-isoquinolin-2-yl]carbonylboron

Systemtic Name: [6-(trifluoromethylsulfonyloxy)-3,4-dihydro-1H-isoquinolin-2-yl]carbonylboron Openeye Name: [6-(trifluoromethylsulfonyloxy)-3,4-dihydro-1H-isoquinoline-2-carbonyl]boron CAS Name: [oxo-[6-(trifluoromethylsulfonyloxy)-3,4-dihydro-1H-isoquinolin-2-yl]methyl]boron IUPAC Name: [6-(trifluoromethylsulfonyloxy)-3,4-dihydro-1H-isoquinoline-2-carbonyl]boron Traditional Name: (6-triflyloxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)boron Formula: C11H9BF3NO4S MolecularWeight: 319.06467

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)N1CCC2=C(C1)C=CC(=C2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

[B]C(=O)N1CCC2=C(C1)C=CC(=C2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H9BF3NO4S/c12-10(17)16-4-3-7-5-9(2-1-8(7)6-16)20-21(18,19)11(13,14)15/h1-2,5H,3-4,6H2