VPK
Summary
Name: | ethyl pyridin-3-ylcarbamate |
Formula: | C8 H10 N2 O2 |
Formal charge: | 0 |
Formula weight: | 166.177 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | ethyl pyridin-3-ylcarbamate |
OpenEye OEToolkits | 2.0.7 | ethyl ~{N}-pyridin-3-ylcarbamate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(OCC)Nc1cccnc1 |
InChI | InChI | 1.06 | InChI=1S/C8H10N2O2/c1-2-12-8(11)10-7-4-3-5-9-6-7/h3-6H,2H2,1H3,(H,10,11) |
InChIKey | InChI | 1.06 | YLRSARVOZNPQKX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)Nc1cccnc1 |
SMILES | CACTVS | 3.385 | CCOC(=O)Nc1cccnc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)Nc1cccnc1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)Nc1cccnc1 |