5WY
Summary
| Name: | 2,3-dihydro-1,4-benzodioxine-5-carboxamide |
| Formula: | C9 H9 N O3 |
| Formal charge: | 0 |
| Formula weight: | 179.173 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | 2,3-dihydro-1,4-benzodioxine-5-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H9NO3/c10-9(11)6-2-1-3-7-8(6)13-5-4-12-7/h1-3H,4-5H2,(H2,10,11) |
| InChIKey | InChI | 1.03 | OIYLTYTXMKZKCR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1cccc2OCCOc12 |
| SMILES | CACTVS | 3.385 | NC(=O)c1cccc2OCCOc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1cc(c2c(c1)OCCO2)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1cc(c2c(c1)OCCO2)C(=O)N |
