A1AJV
Summary
| Name: | 3-ethenyl-1,2-dimethyl-pyrazole |
| Formula: | C7 H11 N2 |
| Formal charge: | 1 |
| Formula weight: | 123.176 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-ethenyl-1,2-dimethyl-1H-pyrazol-2-ium |
| OpenEye OEToolkits | 2.0.7 | 3-ethenyl-1,2-dimethyl-pyrazol-1-ium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C[n+]1ccc(C=C)n1C |
| InChI | InChI | 1.06 | InChI=1S/C7H11N2/c1-4-7-5-6-8(2)9(7)3/h4-6H,1H2,2-3H3/q+1 |
| InChIKey | InChI | 1.06 | RGGYXESXCZRPIW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1c(C=C)cc[n+]1C |
| SMILES | CACTVS | 3.385 | Cn1c(C=C)cc[n+]1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1c(cc[n+]1C)C=C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1c(cc[n+]1C)C=C |
