OU0
2-cyclopropylcarbonyl-3-propan-2-yl-1,2-oxazol-5-one
Created: | 2022-09-20 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 27 |
Chiral Atom Count | 0 |
Bond Count | 28 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 2-cyclopropylcarbonyl-3-propan-2-yl-1,2-oxazol-5-one |
Systematic Name (OpenEye OEToolkits) | 2-cyclopropylcarbonyl-3-propan-2-yl-1,2-oxazol-5-one |
Formula | C10 H13 N O3 |
Molecular Weight | 195.215 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CC(C)C1=CC(=O)ON1C(=O)C2CC2 |
SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C)C1=CC(=O)ON1C(=O)C2CC2 |
Canonical SMILES | CACTVS | 3.385 | CC(C)C1=CC(=O)ON1C(=O)C2CC2 |
Canonical SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C)C1=CC(=O)ON1C(=O)C2CC2 |
InChI | InChI | 1.06 | InChI=1S/C10H13NO3/c1-6(2)8-5-9(12)14-11(8)10(13)7-3-4-7/h5-7H,3-4H2,1-2H3 |
InChIKey | InChI | 1.06 | MMPUYLPCMYQJRV-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 168654883 |