Basic information
- CAS
20958-83-2- Standard SMILES
COC(=O)c1c(C(=O)OC)c2ccc3ccccc3n2c1-c1ccccc1- InChIKey
CBBSWXUQFKLAQV-UHFFFAOYSA-N- Molecular formula
- C22H17NO4
- Average molar mass
- 359.4 g/mol
- Monoisotopic mass
- 359.11575802
Names & identifiers
- Preferred name
- Dimethyl 1-phenylpyrrolo[1,2-a]quinoline-2,3-dicarboxylate
- IUPAC
- dimethyl 1-phenylpyrrolo[1,2-a]quinoline-2,3-dicarboxylate
Names & synonyms
dimethyl 1-phenylpyrrolo[1,2-a]quinoline-2,3-dicarboxylate20958-83-2NSC303528DTXSID30316429NSC-303528
Database identifiers
- CAS
20958-83-2- PubChem CID
- 327604
- DTXSID
DTXSID30316429
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 57 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 559
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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