Basic information
- CAS
5955-63-5- Standard SMILES
Cc1cccc(N2C(=O)C(=O)/C(=C(\O)c3ccccc3)C2c2cccc([N+](=O)[O-])c2)c1- InChIKey
WFPUONNYJFGTTG-XDOYNYLZSA-N- Molecular formula
- C24H18N2O5
- Average molar mass
- 414.4 g/mol
- Monoisotopic mass
- 414.12157168
Names & identifiers
- Preferred name
- (4Z)-4-[hydroxy(phenyl)methylidene]-1-(3-methylphenyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
- IUPAC
- (4Z)-4-[hydroxy(phenyl)methylidene]-1-(3-methylphenyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Names & synonyms
(4Z)-4-[hydroxy(phenyl)methylidene]-1-(3-methylphenyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione5955-63-5AC1NT5GDDTXSID10417266BIM-0009632.P001
Database identifiers
- CAS
5955-63-5- PubChem CID
- 5345321
- DTXSID
DTXSID10417266
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 752
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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