DR8
Summary
| Name: | N,N,N-TRIMETHYLHEPTA-1,3,5-TRIYN-1-AMINIUM |
| Formula: | C10 H12 N |
| Formal charge: | 1 |
| Formula weight: | 146.209 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N,N,N-trimethylhepta-1,3,5-triyn-1-aminium |
| OpenEye OEToolkits | 1.5.0 | hepta-1,3,5-triynyl-trimethyl-azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | C(C#CC#C[N+](C)(C)C)#CC |
| SMILES_CANONICAL | CACTVS | 3.341 | CC#CC#CC#C[N+](C)(C)C |
| SMILES | CACTVS | 3.341 | CC#CC#CC#C[N+](C)(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC#CC#CC#C[N+](C)(C)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC#CC#CC#C[N+](C)(C)C |
| InChI | InChI | 1.03 | InChI=1S/C10H12N/c1-5-6-7-8-9-10-11(2,3)4/h1-4H3/q+1 |
| InChIKey | InChI | 1.03 | AKYJILYZPCHMQA-UHFFFAOYSA-N |
