EPE
Summary
| Name: | 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID |
| Synonyms: | HEPES |
| Formula: | C8 H18 N2 O4 S |
| Formal charge: | 0 |
| Formula weight: | 238.305 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid |
| OpenEye OEToolkits | 1.5.0 | 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(O)CCN1CCN(CCO)CC1 |
| SMILES_CANONICAL | CACTVS | 3.341 | OCCN1CCN(CC1)CC[S](O)(=O)=O |
| SMILES | CACTVS | 3.341 | OCCN1CCN(CC1)CC[S](O)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1CN(CCN1CCO)CCS(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1CN(CCN1CCO)CCS(=O)(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H18N2O4S/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14/h11H,1-8H2,(H,12,13,14) |
| InChIKey | InChI | 1.03 | JKMHFZQWWAIEOD-UHFFFAOYSA-N |
