2-(4-fluorophenyl)-4,5,6,7-tetrahydroisoindol-2-ium-1,3-dione bromide

Systemtic Name: 2-(4-fluorophenyl)-4,5,6,7-tetrahydroisoindol-2-ium-1,3-dione bromide Openeye Name: 2-(4-fluorophenyl)-4,5,6,7-tetrahydroisoindol-2-ium-1,3-dione bromide CAS Name: 2-(4-fluorophenyl)-4,5,6,7-tetrahydroisoindol-2-ium-1,3-dione bromide IUPAC Name: 2-(4-fluorophenyl)-4,5,6,7-tetrahydroisoindol-2-ium-1,3-dione bromide Traditional Name: 2-(4-fluorophenyl)-4,5,6,7-tetrahydroisoindol-2-ium-1,3-quinone bromide Formula: C14H13BrFNO2 MolecularWeight: 326.160923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)[NH+](C2=O)C3=CC=C(C=C3)F.[Br-]

Isomeric SMILES

C1CCC2=C(C1)C(=O)[NH+](C2=O)C3=CC=C(C=C3)F.[Br-]

InChI

InChI=1S/C14H12FNO2.BrH/c15-9-5-7-10(8-6-9)16-13(17)11-3-1-2-4-12(11)14(16)18;/h5-8H,1-4H2;1H