A1I7K
Summary
| Name: | 7-bromanyl-3,4-dihydro-2~{H}-pyrido[3,2-b][1,4]oxazine |
| Formula: | C7 H7 Br N2 O |
| Formal charge: | 0 |
| Formula weight: | 215.047 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 7-bromanyl-3,4-dihydro-2~{H}-pyrido[3,2-b][1,4]oxazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H7BrN2O/c8-5-3-6-7(10-4-5)9-1-2-11-6/h3-4H,1-2H2,(H,9,10) |
| InChIKey | InChI | 1.06 | CYISPVTTZWJFEO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Brc1cnc2NCCOc2c1 |
| SMILES | CACTVS | 3.385 | Brc1cnc2NCCOc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(cnc2c1OCCN2)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(cnc2c1OCCN2)Br |
