K4Q
Summary
| Name: | [(2~{S})-2-azanyl-3-oxidanylidene-propyl] octanoate |
| Formula: | C11 H21 N O3 |
| Formal charge: | 0 |
| Formula weight: | 215.289 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [(2~{S})-2-azanyl-3-oxidanylidene-propyl] octanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H21NO3/c1-2-3-4-5-6-7-11(14)15-9-10(12)8-13/h8,10H,2-7,9,12H2,1H3/t10-/m1/s1 |
| InChIKey | InChI | 1.03 | CSUFCBOFZFUZNV-SNVBAGLBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCC(=O)OC[C@H](N)C=O |
| SMILES | CACTVS | 3.385 | CCCCCCCC(=O)OC[CH](N)C=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCC(=O)OC[C@@H](C=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCC(=O)OCC(C=O)N |
