8L3
Summary
| Name: | 3-[[4-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]methoxy]pyridine |
| Formula: | C18 H20 Cl2 N2 O |
| Formal charge: | 0 |
| Formula weight: | 351.27 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-[[4-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]methoxy]pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H20Cl2N2O/c19-16-4-3-14(10-17(16)20)11-18(5-8-21-9-6-18)13-23-15-2-1-7-22-12-15/h1-4,7,10,12,21H,5-6,8-9,11,13H2 |
| InChIKey | InChI | 1.03 | DFIMBYYXCVFOEJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(CC2(CCNCC2)COc3cccnc3)cc1Cl |
| SMILES | CACTVS | 3.385 | Clc1ccc(CC2(CCNCC2)COc3cccnc3)cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(cnc1)OCC2(CCNCC2)Cc3ccc(c(c3)Cl)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(cnc1)OCC2(CCNCC2)Cc3ccc(c(c3)Cl)Cl |
