O9B
(2~{R})-1-methylpiperidine-2-carboxylic acid
Created: | 2020-02-24 |
Last modified: | 2021-03-31 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 23 |
Chiral Atom Count | 1 |
Bond Count | 23 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2~{R})-1-methylpiperidine-2-carboxylic acid |
Systematic Name (OpenEye OEToolkits) | (2~{R})-1-methylpiperidine-2-carboxylic acid |
Formula | C7 H13 N O2 |
Molecular Weight | 143.184 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CN1CCCC[CH]1C(O)=O |
SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCCCC1C(=O)O |
Canonical SMILES | CACTVS | 3.385 | CN1CCCC[C@@H]1C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCCC[C@@H]1C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C7H13NO2/c1-8-5-3-2-4-6(8)7(9)10/h6H,2-5H2,1H3,(H,9,10)/t6-/m1/s1 |
InChIKey | InChI | 1.03 | BPSLZWSRHTULGU-ZCFIWIBFSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 11286529, 11862129 |