69J
Summary
| Name: | 5-ethyl-4-fluoro-2-(2-nitrophenoxy)phenol |
| Formula: | C14 H12 F N O4 |
| Formal charge: | 0 |
| Formula weight: | 277.248 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-ethyl-4-fluoro-2-(2-nitrophenoxy)phenol |
| OpenEye OEToolkits | 2.0.4 | 5-ethyl-4-fluoranyl-2-(2-nitrophenoxy)phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | [O-][N+](=O)c1ccccc1Oc2cc(F)c(cc2O)CC |
| InChI | InChI | 1.03 | InChI=1S/C14H12FNO4/c1-2-9-7-12(17)14(8-10(9)15)20-13-6-4-3-5-11(13)16(18)19/h3-8,17H,2H2,1H3 |
| InChIKey | InChI | 1.03 | XQDRDJODNDLLTL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCc1cc(O)c(Oc2ccccc2[N+]([O-])=O)cc1F |
| SMILES | CACTVS | 3.385 | CCc1cc(O)c(Oc2ccccc2[N+]([O-])=O)cc1F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CCc1cc(c(cc1F)Oc2ccccc2[N+](=O)[O-])O |
| SMILES | OpenEye OEToolkits | 2.0.4 | CCc1cc(c(cc1F)Oc2ccccc2[N+](=O)[O-])O |
