JEN
Summary
| Name: | 3-METHOXY-6-[4-(3-METHYLPHENYL)-1-PIPERAZINYL]PYRIDAZINE |
| Formula: | C16 H20 N4 O |
| Formal charge: | 0 |
| Formula weight: | 284.356 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-methoxy-6-[4-(3-methylphenyl)piperazin-1-yl]pyridazine |
| OpenEye OEToolkits | 1.5.0 | 3-methoxy-6-[4-(3-methylphenyl)piperazin-1-yl]pyridazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1nc(ccc1OC)N3CCN(c2cc(ccc2)C)CC3 |
| SMILES_CANONICAL | CACTVS | 3.341 | COc1ccc(nn1)N2CCN(CC2)c3cccc(C)c3 |
| SMILES | CACTVS | 3.341 | COc1ccc(nn1)N2CCN(CC2)c3cccc(C)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1cccc(c1)N2CCN(CC2)c3ccc(nn3)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1cccc(c1)N2CCN(CC2)c3ccc(nn3)OC |
| InChI | InChI | 1.03 | InChI=1S/C16H20N4O/c1-13-4-3-5-14(12-13)19-8-10-20(11-9-19)15-6-7-16(21-2)18-17-15/h3-7,12H,8-11H2,1-2H3 |
| InChIKey | InChI | 1.03 | DDOAUTHWSCUHQA-UHFFFAOYSA-N |
