3-([1,2]oxazolo[2,3-a]pyridin-8-ium-2-yl)benzene-1,2-diol bromide

Systemtic Name: 3-([1,2]oxazolo[2,3-a]pyridin-8-ium-2-yl)benzene-1,2-diol bromide Openeye Name: 3-isoxazolo[2,3-a]pyridin-8-ium-2-ylbenzene-1,2-diol bromide CAS Name: 3-(2-isoxazolo[2,3-a]pyridin-8-iumyl)benzene-1,2-diol bromide IUPAC Name: 3-([1,2]oxazolo[2,3-a]pyridin-8-ium-2-yl)benzene-1,2-diol bromide Traditional Name: 3-isoxazolo[2,3-a]pyridin-8-ium-2-ylpyrocatechol bromide Formula: C13H10BrNO3 MolecularWeight: 308.1274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)C=C(O2)C3=C(C(=CC=C3)O)O.[Br-]

Isomeric SMILES

C1=CC=[N+]2C(=C1)C=C(O2)C3=C(C(=CC=C3)O)O.[Br-]

InChI

InChI=1S/C13H9NO3.BrH/c15-11-6-3-5-10(13(11)16)12-8-9-4-1-2-7-14(9)17-12;/h1-8,15H;1H