CAT
Summary
Name: | DODECANE-TRIMETHYLAMINE |
Formula: | C15 H34 N |
Formal charge: | 1 |
Formula weight: | 228.437 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | N,N,N-trimethyldodecan-1-aminium |
OpenEye OEToolkits | 1.5.0 | dodecyl-trimethyl-azanium |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | C(CCCC[N+](C)(C)C)CCCCCCC |
SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCCC[N+](C)(C)C |
SMILES | CACTVS | 3.341 | CCCCCCCCCCCC[N+](C)(C)C |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCC[N+](C)(C)C |
SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCC[N+](C)(C)C |
InChI | InChI | 1.03 | InChI=1S/C15H34N/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4/h5-15H2,1-4H3/q+1 |
InChIKey | InChI | 1.03 | VICYBMUVWHJEFT-UHFFFAOYSA-N |