3V3
Summary
| Name: | 1-amino-3,6,9,12-tetraoxapentadecan-15-oic acid |
| Formula: | C11 H23 N O6 |
| Formal charge: | 0 |
| Formula weight: | 265.303 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-amino-3,6,9,12-tetraoxapentadecan-15-oic acid |
| OpenEye OEToolkits | 1.9.2 | 3-[2-[2-[2-(2-azanylethoxy)ethoxy]ethoxy]ethoxy]propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CCOCCOCCOCCOCCN |
| InChI | InChI | 1.03 | InChI=1S/C11H23NO6/c12-2-4-16-6-8-18-10-9-17-7-5-15-3-1-11(13)14/h1-10,12H2,(H,13,14) |
| InChIKey | InChI | 1.03 | DKUZHSDZSMQOGQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCCOCCOCCOCCOCCC(O)=O |
| SMILES | CACTVS | 3.385 | NCCOCCOCCOCCOCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C(COCCOCCOCCOCCN)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C(COCCOCCOCCOCCN)C(=O)O |
