7F9
Summary
| Name: | ~{N}-[2-(ethylamino)-2-oxidanylidene-ethyl]-~{N}-(4-methoxyphenyl)-2,4-bis(oxidanyl)benzamide |
| Formula: | C18 H20 N2 O5 |
| Formal charge: | 0 |
| Formula weight: | 344.362 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[2-(ethylamino)-2-oxidanylidene-ethyl]-~{N}-(4-methoxyphenyl)-2,4-bis(oxidanyl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H20N2O5/c1-3-19-17(23)11-20(12-4-7-14(25-2)8-5-12)18(24)15-9-6-13(21)10-16(15)22/h4-10,21-22H,3,11H2,1-2H3,(H,19,23) |
| InChIKey | InChI | 1.03 | YRTAPVLIGYRBPY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCNC(=O)CN(C(=O)c1ccc(O)cc1O)c2ccc(OC)cc2 |
| SMILES | CACTVS | 3.385 | CCNC(=O)CN(C(=O)c1ccc(O)cc1O)c2ccc(OC)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCNC(=O)CN(c1ccc(cc1)OC)C(=O)c2ccc(cc2O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCNC(=O)CN(c1ccc(cc1)OC)C(=O)c2ccc(cc2O)O |
