Basic information
- Standard SMILES
CCOC(=O)C(=O)C[n+]1c(N)cnc2ccccc21- InChIKey
RYYIBKFWHNENRJ-UHFFFAOYSA-O- Molecular formula
- C13H14N3O3+
- Average molar mass
- 260.27 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-(2-aminoquinoxalin-1-ium-1-yl)-2-oxopropanoate
- IUPAC
- ethyl 3-(2-aminoquinoxalin-1-ium-1-yl)-2-oxopropanoate
Database identifiers
- PubChem CID
- 20217060
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 86.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 1
- Complexity
- 348
Related reactions
1 records
Compound notes
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