A1EKG
Summary
| Name: | ~{N}-[(4-hydroxyphenyl)methyl]-~{N}-[2-(4-methoxyphenyl)ethyl]morpholine-4-carboxamide |
| Formula: | C21 H26 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 370.442 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[(4-hydroxyphenyl)methyl]-~{N}-[2-(4-methoxyphenyl)ethyl]morpholine-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C21H26N2O4/c1-26-20-8-4-17(5-9-20)10-11-23(16-18-2-6-19(24)7-3-18)21(25)22-12-14-27-15-13-22/h2-9,24H,10-16H2,1H3 |
| InChIKey | InChI | 1.06 | KGDQZQMOXUVVGS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(CCN(Cc2ccc(O)cc2)C(=O)N3CCOCC3)cc1 |
| SMILES | CACTVS | 3.385 | COc1ccc(CCN(Cc2ccc(O)cc2)C(=O)N3CCOCC3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)CCN(Cc2ccc(cc2)O)C(=O)N3CCOCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)CCN(Cc2ccc(cc2)O)C(=O)N3CCOCC3 |
