RN1
Summary
| Name: | (2R)-3-(naphthalen-1-yloxy)propane-1,2-diol |
| Formula: | C13 H14 O3 |
| Formal charge: | 0 |
| Formula weight: | 218.248 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-3-(naphthalen-1-yloxy)propane-1,2-diol |
| OpenEye OEToolkits | 1.7.6 | (2R)-3-naphthalen-1-yloxypropane-1,2-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | OCC(O)COc2cccc1ccccc12 |
| InChI | InChI | 1.03 | InChI=1S/C13H14O3/c14-8-11(15)9-16-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11,14-15H,8-9H2/t11-/m1/s1 |
| InChIKey | InChI | 1.03 | BYNNMWGWFIGTIC-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC[C@@H](O)COc1cccc2ccccc12 |
| SMILES | CACTVS | 3.370 | OC[CH](O)COc1cccc2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)cccc2OC[C@@H](CO)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)cccc2OCC(CO)O |
