1QP
ethyl pyrazolo[1,5-a]pyridine-3-carboxylate
Created: | 2013-04-29 |
Last modified: | 2013-05-17 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 24 |
Chiral Atom Count | 0 |
Bond Count | 25 |
Aromatic Bond Count | 10 |
Chemical Component Summary | |
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Name | ethyl pyrazolo[1,5-a]pyridine-3-carboxylate |
Systematic Name (OpenEye OEToolkits) | ethyl pyrazolo[1,5-a]pyridine-3-carboxylate |
Formula | C10 H10 N2 O2 |
Molecular Weight | 190.199 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(OCC)c1c2ccccn2nc1 |
SMILES | CACTVS | 3.370 | CCOC(=O)c1cnn2ccccc12 |
SMILES | OpenEye OEToolkits | 1.7.6 | CCOC(=O)c1cnn2c1cccc2 |
Canonical SMILES | CACTVS | 3.370 | CCOC(=O)c1cnn2ccccc12 |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | CCOC(=O)c1cnn2c1cccc2 |
InChI | InChI | 1.03 | InChI=1S/C10H10N2O2/c1-2-14-10(13)8-7-11-12-6-4-3-5-9(8)12/h3-7H,2H2,1H3 |
InChIKey | InChI | 1.03 | IDHMFSBXNNIWCT-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 2795464 |
ChEMBL | CHEMBL2326880 |