A1H3M
Summary
| Name: | (2~{S})-5-azanylidene-1-methanoyl-piperidine-2-carboxamide |
| Synonyms: | Avibactam |
| Formula: | C7 H11 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 169.181 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-5-azanylidene-1-methanoyl-piperidine-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H11N3O2/c8-5-1-2-6(7(9)12)10(3-5)4-11/h4,6,8H,1-3H2,(H2,9,12)/b8-5+/t6-/m0/s1 |
| InChIKey | InChI | 1.06 | SVUBAXFAVRYYJU-YTDSJMIDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)[C@@H]1CCC(=N)CN1C=O |
| SMILES | CACTVS | 3.385 | NC(=O)[CH]1CCC(=N)CN1C=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [H]/N=C/1\CC[C@H](N(C1)C=O)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CC(=N)CN(C1C(=O)N)C=O |
