2-pyridin-1-ium-1-ylisoindole-1,3-dione iodide

Systemtic Name: 2-pyridin-1-ium-1-ylisoindole-1,3-dione iodide Openeye Name: 2-pyridin-1-ium-1-ylisoindoline-1,3-dione iodide CAS Name: 2-(1-pyridin-1-iumyl)isoindole-1,3-dione iodide IUPAC Name: 2-pyridin-1-ium-1-ylisoindole-1,3-dione iodide Traditional Name: 2-pyridin-1-ium-1-ylisoindoline-1,3-quinone iodide Formula: C13H9IN2O2 MolecularWeight: 352.12723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)N2C(=O)C3=CC=CC=C3C2=O.[I-]

Isomeric SMILES

C1=CC=[N+](C=C1)N2C(=O)C3=CC=CC=C3C2=O.[I-]

InChI

InChI=1S/C13H9N2O2.HI/c16-12-10-6-2-3-7-11(10)13(17)15(12)14-8-4-1-5-9-14;/h1-9H;1H/q+1;/p-1