Basic information
- Standard SMILES
COC(COc1ccccc1C=Cc1cccc[n+]1C)OC.[I-]- InChIKey
KDYZJZARBQPUAM-UHFFFAOYSA-M- Molecular formula
- C18H22INO3
- Average molar mass
- 427.3 g/mol
- Monoisotopic mass
- 427.06444
Names & identifiers
- Preferred name
- 1-Methyl-2-[o-(2,2-dimethoxyethoxy)-styryl]pyridinium iodide
- IUPAC
- 2-[2-[2-(2,2-dimethoxyethoxy)phenyl]ethenyl]-1-methylpyridin-1-ium iodide
Names & synonyms
SCHEMBL11382982KDYZJZARBQPUAM-UHFFFAOYSA-M1-methyl-2-[o-(2,2-dimethoxyethoxy)-styryl]pyridinium iodide
Database identifiers
- PubChem CID
- 70575863
Properties
Computed structural properties
- Topological polar surface area
- 31.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 330
Related reactions
1 records
Compound notes
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