1-[[(2S)-6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-(trifluoromethyl)pyridin-2-one

Systemtic Name: 1-[[(2S)-6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-(trifluoromethyl)pyridin-2-one Openeye Name: 1-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-(trifluoromethyl)pyridin-2-one CAS Name: 1-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-(trifluoromethyl)-2-pyridinone IUPAC Name: 1-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-(trifluoromethyl)pyridin-2-one Traditional Name: 1-[[(2S)-6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl]methyl]-3-(trifluoromethyl)-2-pyridone Formula: C21H15BrF3NO3 MolecularWeight: 466.24791

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CN4C=CC=C(C4=O)C(F)(F)F)Br

Isomeric SMILES

C1C2=CC(=CC(=C2O[C@H](O1)C3=CC=CC=C3)CN4C=CC=C(C4=O)C(F)(F)F)Br

InChI

InChI=1S/C21H15BrF3NO3/c22-16-9-14(11-26-8-4-7-17(19(26)27)21(23,24)25)18-15(10-16)12-28-20(29-18)13-5-2-1-3-6-13/h1-10,20H,11-12H2/t20-/m0/s1