KSU
1-phenylpyrrolidine-2,5-dione
| Created: | 2022-06-07 |
| Last modified: | 2024-09-27 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 22 |
| Chiral Atom Count | 0 |
| Bond Count | 23 |
| Aromatic Bond Count | 6 |
Chemical Component Summary | |
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| Name | 1-phenylpyrrolidine-2,5-dione |
| Synonyms | N-Phenylmaleimide (reacted form of) |
| Systematic Name (OpenEye OEToolkits) | 1-phenylpyrrolidine-2,5-dione |
| Formula | C10 H9 N O2 |
| Molecular Weight | 175.184 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | CACTVS | 3.385 | O=C1CCC(=O)N1c2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)N2C(=O)CCC2=O |
| Canonical SMILES | CACTVS | 3.385 | O=C1CCC(=O)N1c2ccccc2 |
| Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)N2C(=O)CCC2=O |
| InChI | InChI | 1.06 | InChI=1S/C10H9NO2/c12-9-6-7-10(13)11(9)8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey | InChI | 1.06 | ZTUKZULGOCFJET-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 66519 |
| ChEMBL | CHEMBL579013 |
| CCDC/CSD | GIDPAK |














