C9E
Summary
| Name: | Ethyl 1H-pyrrolo[2,3-b]pyridine-4-carboxylate |
| Formula: | C10 H10 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 190.199 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ethyl 1~{H}-pyrrolo[2,3-b]pyridine-4-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H10N2O2/c1-2-14-10(13)8-4-6-12-9-7(8)3-5-11-9/h3-6H,2H2,1H3,(H,11,12) |
| InChIKey | InChI | 1.03 | CKCBQXQNAUHBDX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)c1ccnc2[nH]ccc12 |
| SMILES | CACTVS | 3.385 | CCOC(=O)c1ccnc2[nH]ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCOC(=O)c1ccnc2c1cc[nH]2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCOC(=O)c1ccnc2c1cc[nH]2 |
