8VJ
Summary
| Name: | 7-[[4-[(dimethylamino)methyl]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-[[4-[(dimethylamino)methyl]phenoxy]methyl]quinolin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H21N3O/c1-22(2)12-14-4-8-17(9-5-14)23-13-15-3-6-16-7-10-19(20)21-18(16)11-15/h3-11H,12-13H2,1-2H3,(H2,20,21) |
| InChIKey | InChI | 1.03 | RSUBEKFHYBPGDT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)Cc1ccc(OCc2ccc3ccc(N)nc3c2)cc1 |
| SMILES | CACTVS | 3.385 | CN(C)Cc1ccc(OCc2ccc3ccc(N)nc3c2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN(C)Cc1ccc(cc1)OCc2ccc3ccc(nc3c2)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CN(C)Cc1ccc(cc1)OCc2ccc3ccc(nc3c2)N |
