BZ3
Summary
| Name: | 5-methoxy-1H-indole |
| Formula: | C9 H9 N O |
| Formal charge: | 0 |
| Formula weight: | 147.174 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 11.02 | 5-methoxy-1H-indole |
| OpenEye OEToolkits | 1.6.1 | 5-methoxy-1H-indole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O(c1cc2c(cc1)ncc2)C |
| SMILES_CANONICAL | CACTVS | 3.352 | COc1ccc2[nH]ccc2c1 |
| SMILES | CACTVS | 3.352 | COc1ccc2[nH]ccc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COc1ccc2c(c1)cc[nH]2 |
| SMILES | OpenEye OEToolkits | 1.7.0 | COc1ccc2c(c1)cc[nH]2 |
| InChI | InChI | 1.03 | InChI=1S/C9H9NO/c1-11-8-2-3-9-7(6-8)4-5-10-9/h2-6,10H,1H3 |
| InChIKey | InChI | 1.03 | DWAQDRSOVMLGRQ-UHFFFAOYSA-N |
