Diethyl(5z)-4-oxo-5-(phenylimino)cyclopentane-1,3-dicarboxylate
Basic information
- CAS
7252-06-4- Standard SMILES
CCOC(=O)C1CC(C(=O)OCC)C(=Nc2ccccc2)C1=O- InChIKey
BCXHWLRGPPABRC-UHFFFAOYSA-N- Molecular formula
- C17H19NO5
- Average molar mass
- 317.34 g/mol
- Monoisotopic mass
- 317.12632271
Names & identifiers
- Preferred name
- Diethyl(5z)-4-oxo-5-(phenylimino)cyclopentane-1,3-dicarboxylate
- IUPAC
- diethyl 4-oxo-5-phenyliminocyclopentane-1,3-dicarboxylate
Names & synonyms
7252-06-4diethyl(5z)-4-oxo-5-(phenylimino)cyclopentane-1,3-dicarboxylateNSC16964DTXSID60280462NSC-16964Diethyl (5Z)-4-oxo-5-(phenylimino)cyclopentane-1,3-dicarboxylate
Database identifiers
- CAS
7252-06-4- PubChem CID
- 226489
- DTXSID
DTXSID60280462
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 82 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 493
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Compound notes
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