Basic information
- Standard SMILES
COC(=O)C1CCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]- InChIKey
BVGGTOOLAZUDPW-UHFFFAOYSA-N- Molecular formula
- C13H14N2O6
- Average molar mass
- 294.26 g/mol
- Monoisotopic mass
- 294.08518617
Names & identifiers
- IUPAC
- methyl 1-(3-hydroxy-2-nitrobenzoyl)pyrrolidine-2-carboxylate
Database identifiers
- PubChem CID
- 20301703
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 435
Related reactions
1 records
Compound notes
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