KIK
Summary
| Name: | (4~{S})-4-azanyl-5-oxidanyl-pent-1-en-3-one |
| Formula: | C5 H9 N O2 |
| Formal charge: | 0 |
| Formula weight: | 115.13 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | (4~{S})-4-azanyl-5-oxidanyl-pent-1-en-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H9NO2/c1-2-5(8)4(6)3-7/h2,4,7H,1,3,6H2/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | UCJPATVGPSMUQX-BYPYZUCNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CO)C(=O)C=C |
| SMILES | CACTVS | 3.385 | N[CH](CO)C(=O)C=C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | C=CC(=O)[C@H](CO)N |
| SMILES | OpenEye OEToolkits | 2.0.5 | C=CC(=O)C(CO)N |
