A1LYK
Summary
| Name: | 2-[2-(dimethylamino)ethoxy]xanthen-9-one |
| Formula: | C17 H17 N O3 |
| Formal charge: | 0 |
| Formula weight: | 283.322 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[2-(dimethylamino)ethoxy]xanthen-9-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H17NO3/c1-18(2)9-10-20-12-7-8-16-14(11-12)17(19)13-5-3-4-6-15(13)21-16/h3-8,11H,9-10H2,1-2H3 |
| InChIKey | InChI | 1.06 | ZMRHVXPPMFZZHV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)CCOc1ccc2Oc3ccccc3C(=O)c2c1 |
| SMILES | CACTVS | 3.385 | CN(C)CCOc1ccc2Oc3ccccc3C(=O)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)CCOc1ccc2c(c1)C(=O)c3ccccc3O2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)CCOc1ccc2c(c1)C(=O)c3ccccc3O2 |
