A1L3Q
Summary
Name: | CpY |
Synonyms: | (2~{R})-2-(diethylamino)-2-(2-ethyl-3-methyl-1-benzofuran-7-yl)ethanol |
Formula: | C17 H25 N O2 |
Formal charge: | 0 |
Formula weight: | 275.386 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (2~{R})-2-(diethylamino)-2-(2-ethyl-3-methyl-1-benzofuran-7-yl)ethanol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C17H25NO2/c1-5-16-12(4)13-9-8-10-14(17(13)20-16)15(11-19)18(6-2)7-3/h8-10,15,19H,5-7,11H2,1-4H3/t15-/m0/s1 |
InChIKey | InChI | 1.06 | FXNNNICQCLNEPG-HNNXBMFYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)[C@@H](CO)c1cccc2c(C)c(CC)oc12 |
SMILES | CACTVS | 3.385 | CCN(CC)[CH](CO)c1cccc2c(C)c(CC)oc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCc1c(c2cccc(c2o1)[C@H](CO)N(CC)CC)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CCc1c(c2cccc(c2o1)C(CO)N(CC)CC)C |