OID
10-(1H-imidazol-1-yl)decanoic acid
Created: | 2009-03-27 |
Last modified: | 2020-06-05 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 39 |
Chiral Atom Count | 0 |
Bond Count | 39 |
Aromatic Bond Count | 5 |
Chemical Component Summary | |
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Name | 10-(1H-imidazol-1-yl)decanoic acid |
Synonyms | 10-imidazolyl-decanoic acid |
Systematic Name (OpenEye OEToolkits) | 10-imidazol-1-yldecanoic acid |
Formula | C13 H22 N2 O2 |
Molecular Weight | 238.326 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCCCCn1ccnc1 |
SMILES | CACTVS | 3.341 | OC(=O)CCCCCCCCCn1ccnc1 |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cn(cn1)CCCCCCCCCC(=O)O |
Canonical SMILES | CACTVS | 3.341 | OC(=O)CCCCCCCCCn1ccnc1 |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | c1cn(cn1)CCCCCCCCCC(=O)O |
InChI | InChI | 1.03 | InChI=1S/C13H22N2O2/c16-13(17)8-6-4-2-1-3-5-7-10-15-11-9-14-12-15/h9,11-12H,1-8,10H2,(H,16,17) |
InChIKey | InChI | 1.03 | DOJPUPKORVKCJK-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 12803316 |