5-bromo-6-methoxyisoquinoline-N-oxide hydrochloride

HCID 68878024
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Basic information

Standard SMILES
COc1ccc2c[n+]([O-])ccc2c1Br.Cl
InChIKey
AIEKZZNUZZONTK-UHFFFAOYSA-N
Molecular formula
C10H9BrClNO2
Average molar mass
290.54 g/mol

Names & identifiers

Preferred name
5-bromo-6-methoxyisoquinoline-N-oxide hydrochloride
IUPAC
5-bromo-6-methoxy-2-oxidoisoquinolin-2-ium;hydrochloride

Names & synonyms

SCHEMBL4014473AIEKZZNUZZONTK-UHFFFAOYSA-N5-bromo-6-methoxyisoquinoline-N-oxide hydrochloride

Database identifiers

PubChem CID
68878024

Properties

Computed structural properties

Topological polar surface area
34.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
15

Related reactions

2 records
New reaction record

Linked notes

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