D3K
Summary
| Name: | (2~{R})-2-[(~{R})-[2-(2-methoxyethoxy)phenyl]-phenyl-methyl]pyrrolidine |
| Formula: | C20 H25 N O2 |
| Formal charge: | 0 |
| Formula weight: | 311.418 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (2~{R})-2-[(~{R})-[2-(2-methoxyethoxy)phenyl]-phenyl-methyl]pyrrolidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C20H25NO2/c1-22-14-15-23-19-12-6-5-10-17(19)20(18-11-7-13-21-18)16-8-3-2-4-9-16/h2-6,8-10,12,18,20-21H,7,11,13-15H2,1H3/t18-,20-/m1/s1 |
| InChIKey | InChI | 1.03 | ZARLKYUJYNEEOE-UYAOXDASSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCCOc1ccccc1[C@H]([C@H]2CCCN2)c3ccccc3 |
| SMILES | CACTVS | 3.385 | COCCOc1ccccc1[CH]([CH]2CCCN2)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COCCOc1ccccc1[C@@H](c2ccccc2)[C@H]3CCCN3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | COCCOc1ccccc1C(c2ccccc2)C3CCCN3 |
