RUJ
Summary
Name: | 3-(1,1,1,2-TETRAMETHYLHYDRAZIN-1-IUM-2-YL)PROPANOATE |
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)-1,1,1,2-tetramethylhydrazinium |
OpenEye OEToolkits | 1.9.2 | [3-hydroxy-3-oxopropyl(methyl)amino]-trimethyl-azanium |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CCN([N+](C)(C)C)C |
InChI | InChI | 1.03 | InChI=1S/C7H16N2O2/c1-8(9(2,3)4)6-5-7(10)11/h5-6H2,1-4H3/p+1 |
InChIKey | InChI | 1.03 | NXHYIEABELXCMM-UHFFFAOYSA-O |
SMILES_CANONICAL | CACTVS | 3.385 | CN(CCC(O)=O)[N+](C)(C)C |
SMILES | CACTVS | 3.385 | CN(CCC(O)=O)[N+](C)(C)C |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN(CCC(=O)O)[N+](C)(C)C |
SMILES | OpenEye OEToolkits | 1.9.2 | CN(CCC(=O)O)[N+](C)(C)C |