5-bromanyl-8-nitro-isoquinolin-2-ium

Systemtic Name: 5-bromanyl-8-nitro-isoquinolin-2-ium Openeye Name: 5-bromo-8-nitro-isoquinolin-2-ium CAS Name: 5-bromo-8-nitroisoquinolin-2-ium IUPAC Name: 5-bromo-8-nitroisoquinolin-2-ium Traditional Name: 5-bromo-8-nitro-isoquinolin-2-ium Formula: C9H6BrN2O2+ MolecularWeight: 254.06014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C[NH+]=CC2=C1[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C2C=C[NH+]=CC2=C1[N+](=O)[O-])Br

InChI

InChI=1S/C9H5BrN2O2/c10-8-1-2-9(12(13)14)7-5-11-4-3-6(7)8/h1-5H/p+1