Basic information
- Standard SMILES
C=C(C[N+](C)(C)C)C1=CCCc2cc(OC)ncc21- InChIKey
CDJYMUZJDWMOCD-UHFFFAOYSA-N- Molecular formula
- C16H23N2O+
- Average molar mass
- 259.37 g/mol
- Monoisotopic mass
- 259.18103836
Names & identifiers
- Preferred name
- 2-(3-Methoxy-5,6-dihydroisoquinolin-8-yl)prop-2-enyl-trimethylazanium
- IUPAC
- 2-(3-methoxy-5,6-dihydroisoquinolin-8-yl)prop-2-enyl-trimethylazanium
Names & synonyms
SCHEMBL11721153
Database identifiers
- PubChem CID
- 21404749
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 1
- Complexity
- 367
Related reactions
1 records
Compound notes
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