F31
Summary
| Name: | 1-(4-azanyl-3-methoxy-phenyl)ethanone |
| Formula: | C9 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 165.189 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 1-(4-azanyl-3-methoxy-phenyl)ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H11NO2/c1-6(11)7-3-4-8(10)9(5-7)12-2/h3-5H,10H2,1-2H3 |
| InChIKey | InChI | 1.03 | LNRPHCWGORQWPI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(ccc1N)C(C)=O |
| SMILES | CACTVS | 3.385 | COc1cc(ccc1N)C(C)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)c1ccc(c(c1)OC)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)c1ccc(c(c1)OC)N |
