1LN
Summary
Name: | 2-(2-aminopyridin-1-ium-1-yl)ethanol |
Formula: | C7 H11 N2 O |
Formal charge: | 1 |
Formula weight: | 139.175 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.7.6 | 2-(2-azanylpyridin-1-yl)ethanol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C7H11N2O/c8-7-3-1-2-4-9(7)5-6-10/h1-4,10H,5-6,8H2 |
InChIKey | InChI | 1.03 | BFRGFNNQJWMZSX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | Nc1ccccn1CCO |
SMILES | CACTVS | 3.370 | Nc1ccccn1CCO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C1=CC=[N](C(=C1)N)CCO |
SMILES | OpenEye OEToolkits | 1.7.6 | C1=CC=[N](C(=C1)N)CCO |