ZV5
(5R)-1,3,7-triazaspiro[4.5]decane-2,4-dione
Created: | 2023-07-05 |
Last modified: | 2023-07-26 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 23 |
Chiral Atom Count | 1 |
Bond Count | 24 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (5R)-1,3,7-triazaspiro[4.5]decane-2,4-dione |
Systematic Name (OpenEye OEToolkits) | (5~{R})-1,3,9-triazaspiro[4.5]decane-2,4-dione |
Formula | C7 H11 N3 O2 |
Molecular Weight | 169.181 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1NC(=O)NC21CCCNC2 |
SMILES | CACTVS | 3.385 | O=C1NC(=O)[C]2(CCCNC2)N1 |
SMILES | OpenEye OEToolkits | 2.0.7 | C1CC2(CNC1)C(=O)NC(=O)N2 |
Canonical SMILES | CACTVS | 3.385 | O=C1NC(=O)[C@]2(CCCNC2)N1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C1C[C@@]2(CNC1)C(=O)NC(=O)N2 |
InChI | InChI | 1.06 | InChI=1S/C7H11N3O2/c11-5-7(10-6(12)9-5)2-1-3-8-4-7/h8H,1-4H2,(H2,9,10,11,12)/t7-/m1/s1 |
InChIKey | InChI | 1.06 | PLFDWSDBRBNQLQ-SSDOTTSWSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 29948024 |