HNU
Summary
| Name: | (2~{S})-2-acetamido-~{N}-prop-2-enyl-pentanediamide |
| Formula: | C10 H17 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 227.26 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-acetamido-~{N}-prop-2-enyl-pentanediamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H17N3O3/c1-3-6-12-10(16)8(13-7(2)14)4-5-9(11)15/h3,8H,1,4-6H2,2H3,(H2,11,15)(H,12,16)(H,13,14)/t8-/m0/s1 |
| InChIKey | InChI | 1.06 | HRGCJYNJCSFORH-QMMMGPOBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N[C@@H](CCC(N)=O)C(=O)NCC=C |
| SMILES | CACTVS | 3.385 | CC(=O)N[CH](CCC(N)=O)C(=O)NCC=C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N[C@@H](CCC(=O)N)C(=O)NCC=C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)NC(CCC(=O)N)C(=O)NCC=C |
