2-(pyridin-1-ium-1-ylmethyl)isoindole-1,3-dione chloride

Systemtic Name: 2-(pyridin-1-ium-1-ylmethyl)isoindole-1,3-dione chloride Openeye Name: 2-(pyridin-1-ium-1-ylmethyl)isoindoline-1,3-dione chloride CAS Name: 2-(1-pyridin-1-iumylmethyl)isoindole-1,3-dione chloride IUPAC Name: 2-(pyridin-1-ium-1-ylmethyl)isoindole-1,3-dione chloride Traditional Name: 2-(pyridin-1-ium-1-ylmethyl)isoindoline-1,3-quinone chloride Formula: C14H11ClN2O2 MolecularWeight: 274.70234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CN2C(=O)C3=CC=CC=C3C2=O.[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)CN2C(=O)C3=CC=CC=C3C2=O.[Cl-]

InChI

InChI=1S/C14H11N2O2.ClH/c17-13-11-6-2-3-7-12(11)14(18)16(13)10-15-8-4-1-5-9-15;/h1-9H,10H2;1H/q+1;/p-1