A1LXX
Summary
Name: | 4-[dodecyl(dimethyl)-$l^{4}-azanyl]butanoic acid |
Formula: | C18 H38 N O2 |
Formal charge: | 1 |
Formula weight: | 300.5 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | dodecyl-dimethyl-(4-oxidanyl-4-oxidanylidene-butyl)azanium |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C18H37NO2/c1-4-5-6-7-8-9-10-11-12-13-16-19(2,3)17-14-15-18(20)21/h4-17H2,1-3H3/p+1 |
InChIKey | InChI | 1.06 | ZFVNBVQBIZJUEY-UHFFFAOYSA-O |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCCCC[N+](C)(C)CCCC(O)=O |
SMILES | CACTVS | 3.385 | CCCCCCCCCCCC[N+](C)(C)CCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCC[N+](C)(C)CCCC(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCC[N+](C)(C)CCCC(=O)O |