2-[2-(4-methylpyridin-1-ium-1-yl)ethoxy]isoindole-1,3-dione bromide

Systemtic Name: 2-[2-(4-methylpyridin-1-ium-1-yl)ethoxy]isoindole-1,3-dione bromide Openeye Name: 2-[2-(4-methylpyridin-1-ium-1-yl)ethoxy]isoindoline-1,3-dione bromide CAS Name: 2-[2-(4-methyl-1-pyridin-1-iumyl)ethoxy]isoindole-1,3-dione bromide IUPAC Name: 2-[2-(4-methylpyridin-1-ium-1-yl)ethoxy]isoindole-1,3-dione bromide Traditional Name: 2-[2-(4-methylpyridin-1-ium-1-yl)ethoxy]isoindoline-1,3-quinone bromide Formula: C16H15BrN2O3 MolecularWeight: 363.2059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CCON2C(=O)C3=CC=CC=C3C2=O.[Br-]

Isomeric SMILES

CC1=CC=[N+](C=C1)CCON2C(=O)C3=CC=CC=C3C2=O.[Br-]

InChI

InChI=1S/C16H15N2O3.BrH/c1-12-6-8-17(9-7-12)10-11-21-18-15(19)13-4-2-3-5-14(13)16(18)20;/h2-9H,10-11H2,1H3;1H/q+1;/p-1