2-[(2-methylpyridin-1-ium-1-yl)methyl]isoindole-1,3-dione bromide

Systemtic Name: 2-[(2-methylpyridin-1-ium-1-yl)methyl]isoindole-1,3-dione bromide Openeye Name: 2-[(2-methylpyridin-1-ium-1-yl)methyl]isoindoline-1,3-dione bromide CAS Name: 2-[(2-methyl-1-pyridin-1-iumyl)methyl]isoindole-1,3-dione bromide IUPAC Name: 2-[(2-methylpyridin-1-ium-1-yl)methyl]isoindole-1,3-dione bromide Traditional Name: 2-[(2-methylpyridin-1-ium-1-yl)methyl]isoindoline-1,3-quinone bromide Formula: C15H13BrN2O2 MolecularWeight: 333.17992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CN2C(=O)C3=CC=CC=C3C2=O.[Br-]

Isomeric SMILES

CC1=CC=CC=[N+]1CN2C(=O)C3=CC=CC=C3C2=O.[Br-]

InChI

InChI=1S/C15H13N2O2.BrH/c1-11-6-4-5-9-16(11)10-17-14(18)12-7-2-3-8-13(12)15(17)19;/h2-9H,10H2,1H3;1H/q+1;/p-1