A1ENS
Summary
| Name: | ~{N}-[3-chloranyl-4-(5-chloranylpyridin-2-yl)oxy-phenyl]pyridine-2-carboxamide |
| Formula: | C17 H11 Cl2 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 360.194 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[3-chloranyl-4-(5-chloranylpyridin-2-yl)oxy-phenyl]pyridine-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H11Cl2N3O2/c18-11-4-7-16(21-10-11)24-15-6-5-12(9-13(15)19)22-17(23)14-3-1-2-8-20-14/h1-10H,(H,22,23) |
| InChIKey | InChI | 1.06 | MZRLPXFGQKQHST-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(Oc2ccc(NC(=O)c3ccccn3)cc2Cl)nc1 |
| SMILES | CACTVS | 3.385 | Clc1ccc(Oc2ccc(NC(=O)c3ccccn3)cc2Cl)nc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C(=O)Nc2ccc(c(c2)Cl)Oc3ccc(cn3)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C(=O)Nc2ccc(c(c2)Cl)Oc3ccc(cn3)Cl |
