Basic information
- Standard SMILES
CCOC(=O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1- InChIKey
JPJPLEHFTKBIGF-UHFFFAOYSA-N- Molecular formula
- C14H19N3O4
- Average molar mass
- 293.32 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(4-(3-nitrophenyl)-1-piperazinyl)-acetate
- IUPAC
- ethyl 2-[4-(3-nitrophenyl)piperazin-1-yl]acetate
Names & synonyms
SCHEMBL2662051JPJPLEHFTKBIGF-UHFFFAOYSA-NEthyl 2-(4-(3-nitrophenyl)-1-piperazinyl)-acetate
Database identifiers
- PubChem CID
- 22330178
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 364
Related reactions
3 records
Compound notes
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