Basic information
- CAS
91545-00-5- Standard SMILES
CCc1c(C(=O)O)c(C(=O)c2ccccc2)cc2c1[nH]c1ccccc12- InChIKey
PAZXOEPSVKYSHX-UHFFFAOYSA-N- Molecular formula
- C22H17NO3
- Average molar mass
- 343.4 g/mol
- Monoisotopic mass
- 343.1208434
Names & identifiers
- Preferred name
- 3-benzoyl-1-ethyl-9H-carbazole-2-carboxylic acid
- IUPAC
- 3-benzoyl-1-ethyl-9H-carbazole-2-carboxylic acid
Names & synonyms
NSC34651391545-00-53-benzoyl-1-ethyl-9H-carbazole-2-carboxylic acidDTXSID10319514NSC-346513
Database identifiers
- CAS
91545-00-5- PubChem CID
- 335708
- DTXSID
DTXSID10319514
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 542
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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