Basic information
- Standard SMILES
COC(=O)C1CCN(c2ccc(C=O)cc2[N+](=O)[O-])CC1- InChIKey
GAPBUJMDWJXRPW-UHFFFAOYSA-N- Molecular formula
- C14H16N2O5
- Average molar mass
- 292.29 g/mol
Names & identifiers
- Preferred name
- Methyl 1-(4-formyl-2-nitrophenyl)piperidine-4-carboxylate
- IUPAC
- methyl 1-(4-formyl-2-nitrophenyl)piperidine-4-carboxylate
Names & synonyms
SCHEMBL3958592methyl 1-(4-formyl-2-nitrophenyl)piperidine-4-carboxylateGAPBUJMDWJXRPW-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 9111291
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 401
Related reactions
4 records
Compound notes
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