N-Hydroxy-2-(1-oxoisoquinolin-2(1H)-yl)propanimidamide--hydrogen chloride (1/1)
Basic information
- CAS
85475-43-0- Standard SMILES
CC(/C(N)=N/O)n1ccc2ccccc2c1=O.Cl- InChIKey
BOXUBMCBMGVWTQ-UHFFFAOYSA-N- Molecular formula
- C12H14ClN3O2
- Average molar mass
- 267.71 g/mol
- Monoisotopic mass
- 267.0774544
Names & identifiers
- Preferred name
- N-Hydroxy-2-(1-oxoisoquinolin-2(1H)-yl)propanimidamide--hydrogen chloride (1/1)
- IUPAC
- N'-hydroxy-2-(1-oxoisoquinolin-2-yl)propanimidamide;hydrochloride
Names & synonyms
85475-43-0DTXSID001006031N-Hydroxy-2-(1-oxoisoquinolin-2(1H)-yl)propanimidamide--hydrogen chloride (1/1)RefChem:1091828DTXCID301432906alpha-Methyl oxo-1 1H-isoquinoleine-2 acetamidoxime chlorhydrate [French]N-Hydroxy-alpha-methyl-1-oxo-2(1H)-isoquinolineethanimidamide monohydrochloride2(1H)-Isoquinolineethanimidamide, N-hydroxy-alpha-methyl-1-oxo-, monohydrochloridealpha-Methyl oxo-1 1H-isoquinoleine-2 acetamidoxime chlorhydrate
Database identifiers
- CAS
85475-43-0- PubChem CID
- 9588643
- DTXSID
DTXSID001006031
Properties
Computed structural properties
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 365
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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