KM0
Summary
| Name: | 8-(benzyloxy)-5-chloroquinoline |
| Formula: | C16 H12 Cl N O |
| Formal charge: | 0 |
| Formula weight: | 269.726 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 8-(benzyloxy)-5-chloroquinoline |
| OpenEye OEToolkits | 1.7.0 | 5-chloro-8-phenylmethoxy-quinoline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc2ccc(OCc1ccccc1)c3ncccc23 |
| SMILES_CANONICAL | CACTVS | 3.370 | Clc1ccc(OCc2ccccc2)c3ncccc13 |
| SMILES | CACTVS | 3.370 | Clc1ccc(OCc2ccccc2)c3ncccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)COc2ccc(c3c2nccc3)Cl |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)COc2ccc(c3c2nccc3)Cl |
| InChI | InChI | 1.03 | InChI=1S/C16H12ClNO/c17-14-8-9-15(16-13(14)7-4-10-18-16)19-11-12-5-2-1-3-6-12/h1-10H,11H2 |
| InChIKey | InChI | 1.03 | LPPVIXWNCVGAJV-UHFFFAOYSA-N |
