C2T
Summary
| Name: | 3-(1-Ethyl-1,1-dimethylhydrazin-1-ium-2-yl)propanoic acid |
| Formula: | C7 H17 N2 O2 |
| Formal charge: | 1 |
| Formula weight: | 161.222 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(2-carboxyethyl)-1-ethyl-1,1-dimethylhydrazinium |
| OpenEye OEToolkits | 1.9.2 | ethyl-(3-hydroxy-3-oxopropylamino)-dimethyl-azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CCN[N+](C)(C)CC |
| InChI | InChI | 1.03 | InChI=1S/C7H16N2O2/c1-4-9(2,3)8-6-5-7(10)11/h8H,4-6H2,1-3H3/p+1 |
| InChIKey | InChI | 1.03 | VFMQJOHSAQMQEH-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[N+](C)(C)NCCC(O)=O |
| SMILES | CACTVS | 3.385 | CC[N+](C)(C)NCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC[N+](C)(C)NCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC[N+](C)(C)NCCC(=O)O |
