S2Y
Summary
| Name: | ~{N}-[(4-fluorophenyl)methyl]-4-methoxy-aniline |
| Formula: | C14 H14 F N O |
| Formal charge: | 0 |
| Formula weight: | 231.265 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[(4-fluorophenyl)methyl]-4-methoxy-aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H14FNO/c1-17-14-8-6-13(7-9-14)16-10-11-2-4-12(15)5-3-11/h2-9,16H,10H2,1H3 |
| InChIKey | InChI | 1.03 | QHNUQKUZGHGTCA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(NCc2ccc(F)cc2)cc1 |
| SMILES | CACTVS | 3.385 | COc1ccc(NCc2ccc(F)cc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1)NCc2ccc(cc2)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1)NCc2ccc(cc2)F |
