Dimethyl 7-benzoylindolizine-1,2-dicarboxylate
Basic information
- CAS
58747-64-1- Standard SMILES
COC(=O)c1cn2ccc(C(=O)c3ccccc3)cc2c1C(=O)OC- InChIKey
ANBZZGSVBGAPDT-UHFFFAOYSA-N- Molecular formula
- C19H15NO5
- Average molar mass
- 337.3 g/mol
- Monoisotopic mass
- 337.09502258
Names & identifiers
- Preferred name
- Dimethyl 7-benzoylindolizine-1,2-dicarboxylate
- IUPAC
- dimethyl 7-benzoylindolizine-1,2-dicarboxylate
Names & synonyms
58747-64-1dimethyl 7-benzoylindolizine-1,2-dicarboxylateNSC236581DTXSID00311042NSC-236581
Database identifiers
- CAS
58747-64-1- PubChem CID
- 314969
- DTXSID
DTXSID00311042
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 74.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 528
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Compound notes
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