Basic information
- CAS
103497-68-3- Standard SMILES
CC(C)CC(=O)C1CCC2C3CCC4NC(=O)C=CC4(C)C3CCC12C- InChIKey
RDPJISLOFXUIDK-UHFFFAOYSA-N- Molecular formula
- C23H35NO2
- Average molar mass
- 357.5 g/mol
- Monoisotopic mass
- 357.26677936
Names & identifiers
- Preferred name
- 1-(2-Hydroxy-4a,6a-dimethyl-4b,5,6,6a,7,8,9,9a,9b,10,11,11a-dodecahydro-4aH-indeno[5,4-f]quinolin-7-yl)-3-methylbutan-1-one
- IUPAC
- 9a,11a-dimethyl-1-(3-methylbutanoyl)-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one
Names & synonyms
DTXSID109084471-(2-Hydroxy-4a,6a-dimethyl-4b,5,6,6a,7,8,9,9a,9b,10,11,11a-dodecahydro-4aH-indeno[5,4-f]quinolin-7-yl)-3-methylbutan-1-one
Database identifiers
- CAS
103497-68-3- PubChem CID
- 59758
- DTXSID
DTXSID10908447
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 638
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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