A1AXJ
Summary
| Name: | [2-(4-ethylpiperazin-1-yl)phenyl]methanol |
| Formula: | C13 H20 N2 O |
| Formal charge: | 0 |
| Formula weight: | 220.311 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | [2-(4-ethylpiperazin-1-yl)phenyl]methanol |
| OpenEye OEToolkits | 2.0.7 | [2-(4-ethylpiperazin-1-yl)phenyl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CCN1CCN(CC1)c1ccccc1CO |
| InChI | InChI | 1.06 | InChI=1S/C13H20N2O/c1-2-14-7-9-15(10-8-14)13-6-4-3-5-12(13)11-16/h3-6,16H,2,7-11H2,1H3 |
| InChIKey | InChI | 1.06 | KRYOTUHYCVJRAS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN1CCN(CC1)c2ccccc2CO |
| SMILES | CACTVS | 3.385 | CCN1CCN(CC1)c2ccccc2CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCN1CCN(CC1)c2ccccc2CO |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCN1CCN(CC1)c2ccccc2CO |
