Basic information
- Standard SMILES
C[N+]1(Cc2ccccc2)CCC(=O)CC1.[I-]- InChIKey
GXCBGFSXHBBEFW-UHFFFAOYSA-M- Molecular formula
- C13H18INO
- Average molar mass
- 331.19 g/mol
Names & identifiers
- Preferred name
- 1-Benzyl-1-methyl-4-oxopiperidinium iodide
- IUPAC
- 1-benzyl-1-methylpiperidin-1-ium-4-one iodide
Names & synonyms
1-benzyl-1-methyl-4-oxopiperidinium iodide77542-27-9MFCD204845771-Benzyl-1-methyl-4-oxopiperidiniumiodide1-benzyl-1-methyl-4-oxopiperidin-1-ium iodide1-benzyl-1-methylpiperidin-1-ium-4-one;iodideSCHEMBL195619GXCBGFSXHBBEFW-UHFFFAOYSA-MAB102121-benzyl-1-methylpiperidin-1-ium-4-oneBS-45447SY260830
Show more names
N-methyl-N-benzyl-4-oxopiperidinium iodide1-benzyl-1-methyl-4-oxo-piperidinium iodideCS-01877891-benzyl-1-methyl-piperidin-1-ium-4-one;iodideF535530
Database identifiers
- PubChem CID
- 11078064
Properties
Computed structural properties
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 221
Related reactions
9 records
Compound notes
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