Basic information
- Standard SMILES
COC(=O)[C@@H]1C[C@]2(CN1)CN(c1cccc(Cl)c1)C(=O)O2- InChIKey
CGKMUDBKIGMANQ-FZMZJTMJSA-N- Molecular formula
- C14H15ClN2O4
- Average molar mass
- 310.73 g/mol
Names & identifiers
- Preferred name
- (5S,8S)-methyl-3-(3-chlorophenyl)-2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-8-carboxylate
- IUPAC
- methyl (5S,8S)-3-(3-chlorophenyl)-2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-8-carboxylate
Names & synonyms
SCHEMBL3512847CGKMUDBKIGMANQ-FZMZJTMJSA-N(5S,8S)-methyl-3-(3-chlorophenyl)-2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-8-carboxylate
Database identifiers
- PubChem CID
- 59547337
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 447
Related reactions
2 records
Compound notes
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