Basic information
- Standard SMILES
CCc1cc2c(cc1OC)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O- InChIKey
LRSYKNYMSUNYIN-UHFFFAOYSA-N- Molecular formula
- C22H20N2O2
- Average molar mass
- 344.4 g/mol
Names & identifiers
- Preferred name
- 9-Ethyl-8-methoxy-6,6-dimethyl-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile
- IUPAC
- 9-ethyl-8-methoxy-6,6-dimethyl-11-oxo-5H-benzo[b]carbazole-3-carbonitrile
Names & synonyms
SCHEMBL897390LRSYKNYMSUNYIN-UHFFFAOYSA-N9-Ethyl-8-methoxy-6,6-dimethyl-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile
Database identifiers
- PubChem CID
- 66834293
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 65.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 621
Related reactions
2 records
Compound notes
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