B0U
Summary
Name: | 3-[2-[2-(2-azanylethoxy)ethoxy]ethoxy]propanoic acid |
Formula: | C9 H19 N O5 |
Formal charge: | 0 |
Formula weight: | 221.251 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 3-[2-[2-(2-azanylethoxy)ethoxy]ethoxy]propanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H19NO5/c10-2-4-14-6-8-15-7-5-13-3-1-9(11)12/h1-8,10H2,(H,11,12) |
InChIKey | InChI | 1.03 | XUQZKSCQPMNDEY-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | NCCOCCOCCOCCC(O)=O |
SMILES | CACTVS | 3.385 | NCCOCCOCCOCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C(COCCOCCOCCN)C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.6 | C(COCCOCCOCCN)C(=O)O |