4EO
Summary
| Name: | 1-(5-ethyl-2,4-dihydroxyphenyl)-1,3-dihydro-2H-benzimidazol-2-one |
| Formula: | C15 H14 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 270.283 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-(5-ethyl-2,4-dihydroxyphenyl)-1,3-dihydro-2H-benzimidazol-2-one |
| OpenEye OEToolkits | 1.9.2 | 3-[5-ethyl-2,4-bis(oxidanyl)phenyl]-1H-benzimidazol-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2Nc1ccccc1N2c3cc(c(cc3O)O)CC |
| InChI | InChI | 1.03 | InChI=1S/C15H14N2O3/c1-2-9-7-12(14(19)8-13(9)18)17-11-6-4-3-5-10(11)16-15(17)20/h3-8,18-19H,2H2,1H3,(H,16,20) |
| InChIKey | InChI | 1.03 | ZNBISFUDIQEGEX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCc1cc(N2C(=O)Nc3ccccc23)c(O)cc1O |
| SMILES | CACTVS | 3.385 | CCc1cc(N2C(=O)Nc3ccccc23)c(O)cc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CCc1cc(c(cc1O)O)N2c3ccccc3NC2=O |
| SMILES | OpenEye OEToolkits | 1.9.2 | CCc1cc(c(cc1O)O)N2c3ccccc3NC2=O |
