848
Summary
| Name: | 2-(pyridin-3-ylmethoxy)aniline |
| Formula: | C12 H12 N2 O |
| Formal charge: | 0 |
| Formula weight: | 200.236 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-(pyridin-3-ylmethoxy)aniline |
| OpenEye OEToolkits | 1.5.0 | 2-(pyridin-3-ylmethoxy)aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O(c1ccccc1N)Cc2cccnc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1ccccc1OCc2cccnc2 |
| SMILES | CACTVS | 3.341 | Nc1ccccc1OCc2cccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)N)OCc2cccnc2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)N)OCc2cccnc2 |
| InChI | InChI | 1.03 | InChI=1S/C12H12N2O/c13-11-5-1-2-6-12(11)15-9-10-4-3-7-14-8-10/h1-8H,9,13H2 |
| InChIKey | InChI | 1.03 | NISBBHHUQZRGQA-UHFFFAOYSA-N |
