3-bromanyl-2-oxidanyl-isoquinolin-2-ium

Systemtic Name: 3-bromanyl-2-oxidanyl-isoquinolin-2-ium Openeye Name: 3-bromo-2-hydroxy-isoquinolin-2-ium CAS Name: 3-bromo-2-hydroxyisoquinolin-2-ium IUPAC Name: 3-bromo-2-hydroxyisoquinolin-2-ium Traditional Name: 3-bromo-2-hydroxy-isoquinolin-2-ium Formula: C9H7BrNO+ MolecularWeight: 225.06198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7BrNO/c10-9-5-7-3-1-2-4-8(7)6-11(9)12/h1-6,12H/q+1