Basic information
- Standard SMILES
CC1(C)C2CC[C@@]1(CS(=O)(=O)O)C(=O)C2.O=C1[C@H]2CCCN[C@H]2C(=O)N1Cc1ccccc1- InChIKey
ONIDGNUMZSYAPT-SJNCZFJNSA-N- Molecular formula
- C24H32N2O6S
- Average molar mass
- 476.6 g/mol
Names & identifiers
- Preferred name
- (1r,6s)-8-benzyl-7,9-dioxo-2,8-diazabicyclo[4.3.0]nonane-(1S)-camphorsulfonic acid salt
- IUPAC
- (4aS,7aR)-6-benzyl-1,2,3,4,4a,7a-hexahydropyrrolo[3,4-b]pyridine-5,7-dione;[(1S)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic acid
Names & synonyms
ONIDGNUMZSYAPT-SJNCZFJNSA-N(1r,6s)-8-benzyl-7,9-dioxo-2,8-diazabicyclo[4.3.0]nonane-(1S)-camphorsulfonic acid salt
Database identifiers
- PubChem CID
- 86758982
Properties
Computed structural properties
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 753
Related reactions
3 records
Compound notes
Loading…