Basic information
- Standard SMILES
COC(=O)c1cccc2c1c1c(n2Cc2ccccc2)CCCC1=O- InChIKey
LRAQLBIAAGYKIS-UHFFFAOYSA-N- Molecular formula
- C21H19NO3
- Average molar mass
- 333.4 g/mol
Names & identifiers
- Preferred name
- 9-[(phenyl)methyl]-5-carbomethoxy-1,2-dihydrocarbazol-4(3H)-one
- IUPAC
- methyl 9-benzyl-5-oxo-7,8-dihydro-6H-carbazole-4-carboxylate
Names & synonyms
9-[(phenyl)methyl]-5-carbomethoxy-1,2-dihydrocarbazol-4(3H)-oneSCHEMBL5207833LRAQLBIAAGYKIS-UHFFFAOYSA-N246513-43-9DB-220079
Database identifiers
- PubChem CID
- 22337728
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 48.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 513
Related reactions
10 records
Compound notes
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