M94
Summary
| Name: | 7-[[3-[2-(methylamino)ethyl]phenoxy]methyl]quinolin-2-amine |
| Formula: | C19 H21 N3 O |
| Formal charge: | 0 |
| Formula weight: | 307.39 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 7-[[3-[2-(methylamino)ethyl]phenoxy]methyl]quinolin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H21N3O/c1-21-10-9-14-3-2-4-17(11-14)23-13-15-5-6-16-7-8-19(20)22-18(16)12-15/h2-8,11-12,21H,9-10,13H2,1H3,(H2,20,22) |
| InChIKey | InChI | 1.03 | IHPWSPZSFKTYCX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCCc1cccc(OCc2ccc3ccc(N)nc3c2)c1 |
| SMILES | CACTVS | 3.385 | CNCCc1cccc(OCc2ccc3ccc(N)nc3c2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CNCCc1cccc(c1)OCc2ccc3ccc(nc3c2)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CNCCc1cccc(c1)OCc2ccc3ccc(nc3c2)N |
