2-(4-nitrophenyl)-[1,3]oxazolo[3,2-a]pyridin-4-ium bromide

Systemtic Name: 2-(4-nitrophenyl)-[1,3]oxazolo[3,2-a]pyridin-4-ium bromide Openeye Name: 2-(4-nitrophenyl)oxazolo[3,2-a]pyridin-4-ium bromide CAS Name: 2-(4-nitrophenyl)oxazolo[3,2-a]pyridin-4-ium bromide IUPAC Name: 2-(4-nitrophenyl)-[1,3]oxazolo[3,2-a]pyridin-4-ium bromide Traditional Name: 2-(4-nitrophenyl)oxazolo[3,2-a]pyridin-4-ium bromide Formula: C13H9BrN2O3 MolecularWeight: 321.12616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C=C(OC2=C1)C3=CC=C(C=C3)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1=CC=[N+]2C=C(OC2=C1)C3=CC=C(C=C3)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C13H9N2O3.BrH/c16-15(17)11-6-4-10(5-7-11)12-9-14-8-2-1-3-13(14)18-12;/h1-9H;1H/q+1;/p-1