2LX
Summary
| Name: | N-methyl-2-(tetrahydro-2H-pyran-4-yloxy)benzamide |
| Formula: | C13 H17 N O3 |
| Formal charge: | 0 |
| Formula weight: | 235.279 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methyl-2-(tetrahydro-2H-pyran-4-yloxy)benzamide |
| OpenEye OEToolkits | 1.7.6 | N-methyl-2-(oxan-4-yloxy)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c2c(OC1CCOCC1)cccc2)NC |
| InChI | InChI | 1.03 | InChI=1S/C13H17NO3/c1-14-13(15)11-4-2-3-5-12(11)17-10-6-8-16-9-7-10/h2-5,10H,6-9H2,1H3,(H,14,15) |
| InChIKey | InChI | 1.03 | WZBIMVSWUWZIHN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)c1ccccc1OC2CCOCC2 |
| SMILES | CACTVS | 3.385 | CNC(=O)c1ccccc1OC2CCOCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CNC(=O)c1ccccc1OC2CCOCC2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CNC(=O)c1ccccc1OC2CCOCC2 |
