A1CYA
Summary
| Name: | (2R)-2-hydroxy-N-[(Z)-(pyridin-2-yl)methylidene]propanamide |
| Formula: | C9 H10 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 178.188 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (2R)-2-hydroxy-N-[(Z)-(pyridin-2-yl)methylidene]propanamide |
| OpenEye OEToolkits | 3.1.0.0 | (~{N}~{Z},2~{R})-2-oxidanyl-~{N}-(pyridin-2-ylmethylidene)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CC(O)C(=O)/N=C\c1ccccn1 |
| InChI | InChI | 1.06 | InChI=1S/C9H10N2O2/c1-7(12)9(13)11-6-8-4-2-3-5-10-8/h2-7,12H,1H3/b11-6-/t7-/m1/s1 |
| InChIKey | InChI | 1.06 | JCEANOGUMUZUGE-KLDHPSGWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](O)C(=O)N=Cc1ccccn1 |
| SMILES | CACTVS | 3.385 | C[CH](O)C(=O)N=Cc1ccccn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@H](C(=O)/N=C\c1ccccn1)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C(=O)N=Cc1ccccn1)O |
