Basic information
- CAS
920802-03-5- Standard SMILES
C[C@@H](c1ccccc1)N1C[C@@H](c2ccc([N+](=O)[O-])cc2)OCC1=O- InChIKey
IEMRMOYBXBZCGZ-GUYCJALGSA-N- Molecular formula
- C18H18N2O4
- Average molar mass
- 326.3 g/mol
- Monoisotopic mass
- 326.12665706
Names & identifiers
- Preferred name
- (6R)-6-(4-Nitrophenyl)-4-[(1S)-1-phenylethyl]morpholin-3-one
- IUPAC
- (6R)-6-(4-nitrophenyl)-4-[(1S)-1-phenylethyl]morpholin-3-one
Names & synonyms
920802-03-5SCHEMBL2299026DTXSID80737125(6R)-6-(4-Nitrophenyl)-4-[(1S)-1-phenylethyl]morpholin-3-one
Database identifiers
- CAS
920802-03-5- PubChem CID
- 67354573
- DTXSID
DTXSID80737125
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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