V1O
Summary
| Name: | 5-[[4-(2-bromoethyl)-3,5-dimethoxy-phenyl]diazenyl]-2-methoxy-phenol |
| Formula: | C17 H19 Br N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 395.248 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-[[4-(2-bromoethyl)-3,5-dimethoxy-phenyl]diazenyl]-2-methoxy-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H19BrN2O4/c1-22-15-5-4-11(8-14(15)21)19-20-12-9-16(23-2)13(6-7-18)17(10-12)24-3/h4-5,8-10,21H,6-7H2,1-3H3 |
| InChIKey | InChI | 1.06 | WFYMKGBDLFAINQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1O)N=Nc2cc(OC)c(CCBr)c(OC)c2 |
| SMILES | CACTVS | 3.385 | COc1ccc(cc1O)N=Nc2cc(OC)c(CCBr)c(OC)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1O)N=Nc2cc(c(c(c2)OC)CCBr)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1O)N=Nc2cc(c(c(c2)OC)CCBr)OC |
