3,4-bis(bromanyl)-1,1-diphenyl-pyrrol-1-ium-2,5-dione bromide

Systemtic Name: 3,4-bis(bromanyl)-1,1-diphenyl-pyrrol-1-ium-2,5-dione bromide Openeye Name: 3,4-dibromo-1,1-diphenyl-pyrrol-1-ium-2,5-dione bromide CAS Name: 3,4-dibromo-1,1-diphenylpyrrol-1-ium-2,5-dione bromide IUPAC Name: 3,4-dibromo-1,1-diphenylpyrrol-1-ium-2,5-dione bromide Traditional Name: 3,4-dibromo-1,1-diphenyl-3-pyrrolin-1-ium-2,5-quinone bromide Formula: C16H10Br3NO2 MolecularWeight: 487.9681

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2(C(=O)C(=C(C2=O)Br)Br)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2(C(=O)C(=C(C2=O)Br)Br)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C16H10Br2NO2.BrH/c17-13-14(18)16(21)19(15(13)20,11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h1-10H;1H/q+1;/p-1