4,5,6-tris(bromanyl)-2-ethyl-isoindol-2-ium-1,3-dione bromide

Systemtic Name: 4,5,6-tris(bromanyl)-2-ethyl-isoindol-2-ium-1,3-dione bromide Openeye Name: 4,5,6-tribromo-2-ethyl-isoindolin-2-ium-1,3-dione bromide CAS Name: 4,5,6-tribromo-2-ethylisoindol-2-ium-1,3-dione bromide IUPAC Name: 4,5,6-tribromo-2-ethylisoindol-2-ium-1,3-dione bromide Traditional Name: 4,5,6-tribromo-2-ethyl-isoindolin-2-ium-1,3-quinone bromide Formula: C10H7Br4NO2 MolecularWeight: 492.78408

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1C(=O)C2=CC(=C(C(=C2C1=O)Br)Br)Br.[Br-]

Isomeric SMILES

CC[NH+]1C(=O)C2=CC(=C(C(=C2C1=O)Br)Br)Br.[Br-]

InChI

InChI=1S/C10H6Br3NO2.BrH/c1-2-14-9(15)4-3-5(11)7(12)8(13)6(4)10(14)16;/h3H,2H2,1H3;1H