6M8
Summary
Name: | 7-[[3-[2-(dimethylamino)ethyl]phenoxy]methyl]quinolin-2-amine |
Formula: | C20 H23 N3 O |
Formal charge: | 0 |
Formula weight: | 321.416 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.7.6 | 7-[[3-[2-(dimethylamino)ethyl]phenoxy]methyl]quinolin-2-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C20H23N3O/c1-23(2)11-10-15-4-3-5-18(12-15)24-14-16-6-7-17-8-9-20(21)22-19(17)13-16/h3-9,12-13H,10-11,14H2,1-2H3,(H2,21,22) |
InChIKey | InChI | 1.03 | TTZAIJYOUAIUID-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN(C)CCc1cccc(OCc2ccc3ccc(N)nc3c2)c1 |
SMILES | CACTVS | 3.385 | CN(C)CCc1cccc(OCc2ccc3ccc(N)nc3c2)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN(C)CCc1cccc(c1)OCc2ccc3ccc(nc3c2)N |
SMILES | OpenEye OEToolkits | 1.7.6 | CN(C)CCc1cccc(c1)OCc2ccc3ccc(nc3c2)N |