2-Amino-7-hydroxyisoquinolinium 2,4,6-trimethylbenzenesulfonate

HCID 117699298
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Basic information

Standard SMILES
Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1.N[n+]1ccc2ccc(O)cc2c1
InChIKey
WUYOALOXANRHCQ-UHFFFAOYSA-N
Molecular formula
C18H20N2O4S
Average molar mass
360.4 g/mol

Names & identifiers

Preferred name
2-Amino-7-hydroxyisoquinolinium 2,4,6-trimethylbenzenesulfonate
IUPAC
2-aminoisoquinolin-2-ium-7-ol;2,4,6-trimethylbenzenesulfonate

Names & synonyms

SCHEMBL16239249SCHEMBL30697862WUYOALOXANRHCQ-UHFFFAOYSA-N2-amino-7-hydroxyisoquinolinium 2,4,6-trimethylbenzenesulfonate

Database identifiers

PubChem CID
117699298

Properties

Computed structural properties

Topological polar surface area
116 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
0
Heavy atoms
25

Related reactions

1 records
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Compound notes

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