LCY
1-methylpyrrolidine-2,5-dione
Created: | 2009-05-22 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 15 |
Chiral Atom Count | 0 |
Bond Count | 15 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 1-methylpyrrolidine-2,5-dione |
Systematic Name (OpenEye OEToolkits) | 1-methylpyrrolidine-2,5-dione |
Formula | C5 H7 N O2 |
Molecular Weight | 113.115 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C1N(C(=O)CC1)C |
SMILES | CACTVS | 3.341 | CN1C(=O)CCC1=O |
SMILES | OpenEye OEToolkits | 1.5.0 | CN1C(=O)CCC1=O |
Canonical SMILES | CACTVS | 3.341 | CN1C(=O)CCC1=O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | CN1C(=O)CCC1=O |
InChI | InChI | 1.03 | InChI=1S/C5H7NO2/c1-6-4(7)2-3-5(6)8/h2-3H2,1H3 |
InChIKey | InChI | 1.03 | KYEACNNYFNZCST-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 70717 |
ChEMBL | CHEMBL317929 |
CCDC/CSD | KOMYEQ01, KOMYEQ |
COD | 2010914 |