2-(2-chloranylpyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone bromide

Systemtic Name: 2-(2-chloranylpyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone bromide Openeye Name: 2-(2-chloropyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone bromide CAS Name: 2-(2-chloro-1-pyridin-1-iumyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone bromide IUPAC Name: 2-(2-chloropyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone bromide Traditional Name: 2-(2-chloropyridin-1-ium-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone bromide Formula: C15H13BrClNO3 MolecularWeight: 370.62562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)C[N+]3=CC=CC=C3Cl.[Br-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)C[N+]3=CC=CC=C3Cl.[Br-]

InChI

InChI=1S/C15H13ClNO3.BrH/c16-15-3-1-2-6-17(15)10-12(18)11-4-5-13-14(9-11)20-8-7-19-13;/h1-6,9H,7-8,10H2;1H/q+1;/p-1