U9O
5-azanyl-1-oxidanyl-pentan-2-one
Created: | 2023-08-31 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 19 |
Chiral Atom Count | 0 |
Bond Count | 18 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 5-azanyl-1-oxidanyl-pentan-2-one |
Systematic Name (OpenEye OEToolkits) | 5-azanyl-1-oxidanyl-pentan-2-one |
Formula | C5 H11 N O2 |
Molecular Weight | 117.146 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | NCCCC(=O)CO |
SMILES | OpenEye OEToolkits | 2.0.7 | C(CC(=O)CO)CN |
Canonical SMILES | CACTVS | 3.385 | NCCCC(=O)CO |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C(CC(=O)CO)CN |
InChI | InChI | 1.06 | InChI=1S/C5H11NO2/c6-3-1-2-5(8)4-7/h7H,1-4,6H2 |
InChIKey | InChI | 1.06 | RXEZLKNFLIROMJ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 54290566 |