8WS
Summary
| Name: | (2S)-2,6-diacetamido-N-methyl-hexanamide |
| Formula: | C11 H21 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 243.303 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | (2S)-2,6-diacetamido-N-methyl-hexanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H21N3O3/c1-8(15)13-7-5-4-6-10(11(17)12-3)14-9(2)16/h10H,4-7H2,1-3H3,(H,12,17)(H,13,15)(H,14,16)/t10-/m0/s1 |
| InChIKey | InChI | 1.03 | RWBIXQSLRNBRKV-JTQLQIEISA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)[C@H](CCCCNC(C)=O)NC(C)=O |
| SMILES | CACTVS | 3.385 | CNC(=O)[CH](CCCCNC(C)=O)NC(C)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=O)NCCCC[C@@H](C(=O)NC)NC(=O)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=O)NCCCCC(C(=O)NC)NC(=O)C |
