UWI
oxane-4-carboxamide
Created: | 2022-08-26 |
Last modified: | 2022-11-02 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 20 |
Chiral Atom Count | 0 |
Bond Count | 20 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | oxane-4-carboxamide |
Systematic Name (OpenEye OEToolkits) | oxane-4-carboxamide |
Formula | C6 H11 N O2 |
Molecular Weight | 129.157 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NC(=O)C1CCOCC1 |
SMILES | CACTVS | 3.385 | NC(=O)C1CCOCC1 |
SMILES | OpenEye OEToolkits | 2.0.7 | C1COCCC1C(=O)N |
Canonical SMILES | CACTVS | 3.385 | NC(=O)C1CCOCC1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C1COCCC1C(=O)N |
InChI | InChI | 1.06 | InChI=1S/C6H11NO2/c7-6(8)5-1-3-9-4-2-5/h5H,1-4H2,(H2,7,8) |
InChIKey | InChI | 1.06 | DGOYLVBDCVINQZ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 13197203 |