Basic information
- Standard SMILES
Cl.NC[C@H]1O[C@H](c2ccccc2Cl)c2cc(Cl)ccc2N(Cc2ccccc2)C1=O- InChIKey
UMHKDRUOGOWUSK-HLUKFBSCSA-N- Molecular formula
- C23H21Cl3N2O2
- Average molar mass
- 463.8 g/mol
Names & identifiers
- Preferred name
- [trans-1-Benzyl-7-chloro-5-(2-chlorophenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepine-3-yl]methylamine hydrochloride
- IUPAC
- (3R,5S)-3-(aminomethyl)-1-benzyl-7-chloro-5-(2-chlorophenyl)-5H-4,1-benzoxazepin-2-one;hydrochloride
Names & synonyms
SCHEMBL6962975UMHKDRUOGOWUSK-HLUKFBSCSA-N[trans-1-benzyl-7-chloro-5-(2-chlorophenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepine-3-yl]methylamine hydrochloride
Database identifiers
- PubChem CID
- 69947635
Properties
Computed structural properties
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 557
Related reactions
2 records
Compound notes
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