6-(4-bromanyl-3-oxidanylidene-butyl)pyrrolo[3,4-b]pyridin-1-ium-5,7-dione

Systemtic Name: 6-(4-bromanyl-3-oxidanylidene-butyl)pyrrolo[3,4-b]pyridin-1-ium-5,7-dione Openeye Name: 6-(4-bromo-3-oxo-butyl)pyrrolo[3,4-b]pyridin-1-ium-5,7-dione CAS Name: 6-(4-bromo-3-oxobutyl)pyrrolo[3,4-b]pyridin-1-ium-5,7-dione IUPAC Name: 6-(4-bromo-3-oxobutyl)pyrrolo[3,4-b]pyridin-1-ium-5,7-dione Traditional Name: 6-(4-bromo-3-keto-butyl)pyrrolo[3,4-b]pyridin-1-ium-5,7-quinone Formula: C11H10BrN2O3+ MolecularWeight: 298.1127

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=O)N(C2=O)CCC(=O)CBr)[NH+]=C1

Isomeric SMILES

C1=CC2=C(C(=O)N(C2=O)CCC(=O)CBr)[NH+]=C1

InChI

InChI=1S/C11H9BrN2O3/c12-6-7(15)3-5-14-10(16)8-2-1-4-13-9(8)11(14)17/h1-2,4H,3,5-6H2/p+1