GEB
Summary
Name: | 3-[4-(3-oxidanylidenepropyl)piperazin-1-yl]propanal |
Formula: | C10 H18 N2 O2 |
Formal charge: | 0 |
Formula weight: | 198.262 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 3-[4-(3-oxidanylidenepropyl)piperazin-1-yl]propanal |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C10H18N2O2/c13-9-1-3-11-5-7-12(8-6-11)4-2-10-14/h9-10H,1-8H2 |
InChIKey | InChI | 1.03 | YNICZMOQZCCMFE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=CCCN1CCN(CCC=O)CC1 |
SMILES | CACTVS | 3.385 | O=CCCN1CCN(CCC=O)CC1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1CN(CCN1CCC=O)CCC=O |
SMILES | OpenEye OEToolkits | 2.0.6 | C1CN(CCN1CCC=O)CCC=O |