30G
Summary
| Name: | 3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzoxazin-2(1H)-one |
| Formula: | C10 H9 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 203.197 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzoxazin-2(1H)-one |
| OpenEye OEToolkits | 1.7.6 | 3,5-dihydro-1H-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C3NN=C1N(c2c(OC1)cccc2)C3 |
| InChI | InChI | 1.03 | InChI=1S/C10H9N3O2/c14-10-5-13-7-3-1-2-4-8(7)15-6-9(13)11-12-10/h1-4H,5-6H2,(H,12,14) |
| InChIKey | InChI | 1.03 | PNPBXXNNLJGHBP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1CN2C(=NN1)COc3ccccc23 |
| SMILES | CACTVS | 3.385 | O=C1CN2C(=NN1)COc3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)N3CC(=O)NN=C3CO2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)N3CC(=O)NN=C3CO2 |
