UBQ
Summary
Name: | 4-methyl-~{N}-undecyl-pyridine-1-carboxamide |
Formula: | C18 H36 N2 O |
Formal charge: | 0 |
Formula weight: | 296.491 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-methyl-~{N}-undecyl-3,4,5,6-tetrahydro-2~{H}-pyridine-1-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C18H36N2O/c1-3-4-5-6-7-8-9-10-11-14-19-18(21)20-15-12-17(2)13-16-20/h17H,3-16H2,1-2H3,(H,19,21)/p+1 |
InChIKey | InChI | 1.03 | SYMUTLCUVXEJOU-UHFFFAOYSA-O |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCCCNC(=O)[N+]1CCC(C)CC1 |
SMILES | CACTVS | 3.385 | CCCCCCCCCCCNC(=O)[N+]1CCC(C)CC1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCNC(=O)[N+]1CCC(CC1)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCNC(=O)[N+]1CCC(CC1)C |