NSB
Summary
| Name: | N,N,N-TRIMETHYL-3-SULFOPROPAN-1-AMINIUM |
| Formula: | C6 H16 N O3 S |
| Formal charge: | 1 |
| Formula weight: | 182.261 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N,N,N-trimethyl-3-sulfopropan-1-aminium |
| OpenEye OEToolkits | 1.5.0 | trimethyl-(3-sulfopropyl)azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(O)CCC[N+](C)(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[N+](C)(C)CCC[S](O)(=O)=O |
| SMILES | CACTVS | 3.341 | C[N+](C)(C)CCC[S](O)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[N+](C)(C)CCCS(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C[N+](C)(C)CCCS(=O)(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H15NO3S/c1-7(2,3)5-4-6-11(8,9)10/h4-6H2,1-3H3/p+1 |
| InChIKey | InChI | 1.03 | WFJHXXPYPMNRPK-UHFFFAOYSA-O |
