A1CGV
Summary
| Name: | 2-[4-(benzyloxy)phenoxy]-N-ethylethan-1-amine |
| Formula: | C17 H21 N O2 |
| Formal charge: | 0 |
| Formula weight: | 271.354 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 2-[4-(benzyloxy)phenoxy]-N-ethylethan-1-amine |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-ethyl-2-(4-phenylmethoxyphenoxy)ethanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CCNCCOc1ccc(cc1)OCc1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C17H21NO2/c1-2-18-12-13-19-16-8-10-17(11-9-16)20-14-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3 |
| InChIKey | InChI | 1.06 | DLYGRQINMSKZKQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCNCCOc1ccc(OCc2ccccc2)cc1 |
| SMILES | CACTVS | 3.385 | CCNCCOc1ccc(OCc2ccccc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CCNCCOc1ccc(cc1)OCc2ccccc2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CCNCCOc1ccc(cc1)OCc2ccccc2 |
