7-oxidanyl-2H-isoquinolin-6-one hydrate hydrobromide

Systemtic Name: 7-oxidanyl-2H-isoquinolin-6-one hydrate hydrobromide Openeye Name: 7-hydroxy-2H-isoquinolin-6-one hydrate hydrobromide CAS Name: 7-hydroxy-2H-isoquinolin-6-one hydrate hydrobromide IUPAC Name: 7-hydroxy-2H-isoquinolin-6-one hydrate hydrobromide Traditional Name: 7-hydroxy-2H-isoquinolin-6-one hydrate hydrobromide Formula: C9H10BrNO3 MolecularWeight: 260.0846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC=C2C1=CC(=O)C(=C2)O.O.Br

Isomeric SMILES

C1=CNC=C2C1=CC(=O)C(=C2)O.O.Br

InChI

InChI=1S/C9H7NO2.BrH.H2O/c11-8-3-6-1-2-10-5-7(6)4-9(8)12;;/h1-5,10,12H;1H;1H2