GD0
Summary
| Name: | 1-[2-(ethoxymethyl)-4-iodanyl-5-phenyl-imidazol-1-yl]-2-methyl-propan-2-ol |
| Formula: | C16 H21 I N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 400.255 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-[2-(ethoxymethyl)-4-iodanyl-5-phenyl-imidazol-1-yl]-2-methyl-propan-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H21IN2O2/c1-4-21-10-13-18-15(17)14(12-8-6-5-7-9-12)19(13)11-16(2,3)20/h5-9,20H,4,10-11H2,1-3H3 |
| InChIKey | InChI | 1.03 | XCYMSVIYUJTAPJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOCc1nc(I)c(n1CC(C)(C)O)c2ccccc2 |
| SMILES | CACTVS | 3.385 | CCOCc1nc(I)c(n1CC(C)(C)O)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOCc1nc(c(n1CC(C)(C)O)c2ccccc2)I |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOCc1nc(c(n1CC(C)(C)O)c2ccccc2)I |
