UCH
Summary
Name: | 1-pyridin-4-ylpiperidine-4-carboxylic acid |
Formula: | C11 H14 N2 O2 |
Formal charge: | 0 |
Formula weight: | 206.241 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 1-pyridin-4-ylpiperidine-4-carboxylic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C11H14N2O2/c14-11(15)9-3-7-13(8-4-9)10-1-5-12-6-2-10/h1-2,5-6,9H,3-4,7-8H2,(H,14,15) |
InChIKey | InChI | 1.06 | UISWRUUBFFHGLE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C1CCN(CC1)c2ccncc2 |
SMILES | CACTVS | 3.385 | OC(=O)C1CCN(CC1)c2ccncc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cnccc1N2CCC(CC2)C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cnccc1N2CCC(CC2)C(=O)O |