MR3
Summary
| Name: | 1-METHYL-1H-PYRROLE |
| Formula: | C5 H7 N |
| Formal charge: | 0 |
| Formula weight: | 81.116 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-methyl-1H-pyrrole |
| OpenEye OEToolkits | 1.5.0 | 1-methylpyrrole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | c1cccn1C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cn1cccc1 |
| SMILES | CACTVS | 3.341 | Cn1cccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cn1cccc1 |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cn1cccc1 |
| InChI | InChI | 1.03 | InChI=1S/C5H7N/c1-6-4-2-3-5-6/h2-5H,1H3 |
| InChIKey | InChI | 1.03 | OXHNLMTVIGZXSG-UHFFFAOYSA-N |
