A1EC2
Summary
| Name: | 2-chloranyl-3-(4-ethoxyphenoxy)-6-nitro-aniline |
| Formula: | C14 H13 Cl N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 308.717 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-chloranyl-3-(4-ethoxyphenoxy)-6-nitro-aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H13ClN2O4/c1-2-20-9-3-5-10(6-4-9)21-12-8-7-11(17(18)19)14(16)13(12)15/h3-8H,2,16H2,1H3 |
| InChIKey | InChI | 1.06 | XYAAULHPCLPUBP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOc1ccc(Oc2ccc(c(N)c2Cl)[N](=O)=O)cc1 |
| SMILES | CACTVS | 3.385 | CCOc1ccc(Oc2ccc(c(N)c2Cl)[N](=O)=O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOc1ccc(cc1)Oc2ccc(c(c2Cl)N)N(=O)=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOc1ccc(cc1)Oc2ccc(c(c2Cl)N)N(=O)=O |
