Basic information
- Standard SMILES
CN(C)C(=O)Oc1ccc[n+](COC(=O)C2CC2)c1- InChIKey
HAVRANUDGATJCP-UHFFFAOYSA-N- Molecular formula
- C13H17N2O4+
- Average molar mass
- 265.28 g/mol
- Monoisotopic mass
- 265.11883203
Names & identifiers
- Preferred name
- [3-(Dimethylcarbamoyloxy)pyridin-1-ium-1-yl]methyl cyclopropanecarboxylate
- IUPAC
- [3-(dimethylcarbamoyloxy)pyridin-1-ium-1-yl]methyl cyclopropanecarboxylate
Database identifiers
- PubChem CID
- 20205839
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 59.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 1
- Complexity
- 342
Related reactions
1 records
Compound notes
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