9AG
Summary
| Name: | N-methyl-1-(4-phenoxyphenyl)methanamine |
| Formula: | C14 H15 N O |
| Formal charge: | 0 |
| Formula weight: | 213.275 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methyl-1-(4-phenoxyphenyl)methanamine |
| OpenEye OEToolkits | 2.0.6 | ~{N}-methyl-1-(4-phenoxyphenyl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2cccc(Oc1ccc(CNC)cc1)c2 |
| InChI | InChI | 1.03 | InChI=1S/C14H15NO/c1-15-11-12-7-9-14(10-8-12)16-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3 |
| InChIKey | InChI | 1.03 | YWBKPTGYRUSBFV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCc1ccc(Oc2ccccc2)cc1 |
| SMILES | CACTVS | 3.385 | CNCc1ccc(Oc2ccccc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CNCc1ccc(cc1)Oc2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNCc1ccc(cc1)Oc2ccccc2 |
