BK0
Summary
Name: | N-(3-chlorophenyl)pyridine-2-carboxamide |
Formula: | C12 H9 Cl N2 O |
Formal charge: | 0 |
Formula weight: | 232.666 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-(3-chlorophenyl)pyridine-2-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C12H9ClN2O/c13-9-4-3-5-10(8-9)15-12(16)11-6-1-2-7-14-11/h1-8H,(H,15,16) |
InChIKey | InChI | 1.06 | SUYUTNCKIOLMAJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1cccc(NC(=O)c2ccccn2)c1 |
SMILES | CACTVS | 3.385 | Clc1cccc(NC(=O)c2ccccn2)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C(=O)Nc2cccc(c2)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C(=O)Nc2cccc(c2)Cl |