A1EDC
Summary
| Name: | 1~{H}-pyrrolo[2,3-b]pyridine-4-carbaldehyde |
| Formula: | C8 H6 N2 O |
| Formal charge: | 0 |
| Formula weight: | 146.146 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1~{H}-pyrrolo[2,3-b]pyridine-4-carbaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C8H6N2O/c11-5-6-1-3-9-8-7(6)2-4-10-8/h1-5H,(H,9,10) |
| InChIKey | InChI | 1.06 | IEPOMBHPYZJZNR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=Cc1ccnc2[nH]ccc12 |
| SMILES | CACTVS | 3.385 | O=Cc1ccnc2[nH]ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c[nH]c2c1c(ccn2)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c[nH]c2c1c(ccn2)C=O |
